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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16N2.ClH.H2O
Molecular Weight 242.745
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IPIDACRINE HYDROCHLORIDE MONOHYDRATE

SMILES

O.Cl.NC1=C2CCCCC2=NC3=C1CCC3

InChI

InChIKey=SBTIBNSPYUUNGA-UHFFFAOYSA-N
InChI=1S/C12H16N2.ClH.H2O/c13-12-8-4-1-2-6-10(8)14-11-7-3-5-9(11)12;;/h1-7H2,(H2,13,14);1H;1H2

HIDE SMILES / InChI
Molecular Formula C12H16N2
Molecular Weight 188.2688
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Sat Dec 16 06:02:24 UTC 2023
Edited
by admin
on Sat Dec 16 06:02:24 UTC 2023
Record UNII
OV96AIK79Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IPIDACRINE HYDROCHLORIDE MONOHYDRATE
MI  
Common Name English
1H-CYCLOPENTA(B)QUINOLIN-9-AMINE, 2,3,5,6,7,8-HEXAHYDRO-, MONOHYDROCHLORIDE, MONOHYDRATE
Common Name English
1H-CYCLOPENTA(B)QUINOLIN-9-AMINE, 2,3,5,6,7,8-HEXAHYDRO-, HYDROCHLORIDE, HYDRATE (1:1:1)
Systematic Name English
IPIDACRINE MONOHYDROCHLORIDE MONOHYDRATE
Common Name English
IPIDACRINE HYDROCHLORIDE MONOHYDRATE [MI]
Common Name English
IPIDACRINE HYDROCHLORIDE HYDRATE [JAN]
Common Name English
IPIDACRINE HYDROCHLORIDE HYDRATE
JAN  
Common Name English
Code System Code Type Description
CAS
118499-70-0
Created by admin on Sat Dec 16 06:02:25 UTC 2023 , Edited by admin on Sat Dec 16 06:02:25 UTC 2023
PRIMARY
SMS_ID
100000174702
Created by admin on Sat Dec 16 06:02:25 UTC 2023 , Edited by admin on Sat Dec 16 06:02:25 UTC 2023
PRIMARY
MERCK INDEX
m776
Created by admin on Sat Dec 16 06:02:25 UTC 2023 , Edited by admin on Sat Dec 16 06:02:25 UTC 2023
PRIMARY
EPA CompTox
DTXSID9046734
Created by admin on Sat Dec 16 06:02:25 UTC 2023 , Edited by admin on Sat Dec 16 06:02:25 UTC 2023
PRIMARY
PUBCHEM
6917941
Created by admin on Sat Dec 16 06:02:25 UTC 2023 , Edited by admin on Sat Dec 16 06:02:25 UTC 2023
PRIMARY
FDA UNII
OV96AIK79Q
Created by admin on Sat Dec 16 06:02:25 UTC 2023 , Edited by admin on Sat Dec 16 06:02:25 UTC 2023
PRIMARY
Related Record Type Details
Structure of IPIDACRINE
PARENT -> SALT/SOLVATE
Structure of IPIDACRINE MONOHYDROCHLORIDE
ANHYDROUS->SOLVATE
Related Record Type Details
Structure of IPIDACRINE
ACTIVE MOIETY
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