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Details

Stereochemistry RACEMIC
Molecular Formula C22H32N2O5
Molecular Weight 404.4999
Optical Activity ( + / - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZQUINAMIDE

SMILES

[H][C@@]12C[C@@H](OC(C)=O)[C@@H](CN1CCC3=C2C=C(OC)C(OC)=C3)C(=O)N(CC)CC

InChI

InChIKey=JSZILQVIPPROJI-CEXWTWQISA-N
InChI=1S/C22H32N2O5/c1-6-23(7-2)22(26)17-13-24-9-8-15-10-20(27-4)21(28-5)11-16(15)18(24)12-19(17)29-14(3)25/h10-11,17-19H,6-9,12-13H2,1-5H3/t17-,18+,19-/m1/s1

HIDE SMILES / InChI
Molecular Formula C22H32N2O5
Molecular Weight 404.4999
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Sat Dec 16 16:51:16 UTC 2023
Edited
by admin
on Sat Dec 16 16:51:16 UTC 2023
Record UNII
0475EA27Q3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZQUINAMIDE
HSDB   INN   MI   USAN   VANDF   WHO-DD  
USAN   INN  
Official Name English
PROMECON
Brand Name English
2H-BENZO(A)QUINOLIZINE-3-CARBOXAMIDE, 2-(ACETYLOXY)-N,N-DIETHYL-1,3,4,6,7,11B-HEXAHYDRO-9,10-DIMETHOXY-, (2R,3R,11BS)-REL-
Systematic Name English
BENZQUINAMIDE [MI]
Common Name English
Benzquinamide [WHO-DD]
Common Name English
QUANTRIL
Brand Name English
BENZQUINAMIDE [VANDF]
Common Name English
benzquinamide [INN]
Common Name English
NSC-169193
Code English
BENZQUINAMIDE [USAN]
Common Name English
NSC-108159
Code English
P-2647
Code English
N,N-Diethyl-1,3,4,6,7,11b-hexahydro-2-hydroxy-9,10-dimethoxy-2H-benzo[a]quinolizine-3-carboxamide acetate (ester)
Common Name English
BENZQUINAMIDE [HSDB]
Common Name English
2H-BENZO(A)QUINOLIZINE-3-CARBOXAMIDE, 2-(ACETYLOXY)-N,N-DIETHYL-1,3,4,6,7,11B-HEXAHYDRO-9,10-DIMETHOXY-
Common Name English
EMETE-CON
Brand Name English
NSC-64375
Code English
Classification Tree Code System Code
NCI_THESAURUS C267
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
Code System Code Type Description
NSC
64375
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
HSDB
63-12-7
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
CAS
63-12-7
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
NON-SPECIFIC STEREOCHEMISTRY
NSC
108159
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
WIKIPEDIA
BENZQUINAMIDE
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
EVMPD
SUB05768MIG
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
MERCK INDEX
m2392
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY Merck Index
MESH
C100234
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
RXCUI
19041
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY RxNorm
IUPHAR
7124
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
PUBCHEM
23615589
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
SMS_ID
100000086413
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
EPA CompTox
DTXSID9022657
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
FDA UNII
0475EA27Q3
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
NCI_THESAURUS
C65253
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
NSC
169193
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
DRUG CENTRAL
331
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
CAS
23844-24-8
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
INN
1402
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
DRUG BANK
DB00767
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
CHEBI
27662
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
ChEMBL
CHEMBL1201250
Created by admin on Sat Dec 16 16:51:17 UTC 2023 , Edited by admin on Sat Dec 16 16:51:17 UTC 2023
PRIMARY
Related Record Type Details
Structure of BENZQUINAMIDE HYDROCHLORIDE
SALT/SOLVATE -> PARENT
Related Record Type Details
Structure of BENZQUINAMIDE
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