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Details

Stereochemistry ACHIRAL
Molecular Formula C17H19N3O.ClH
Molecular Weight 317.813
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENTOLAMINE HYDROCHLORIDE

SMILES

Cl.CC1=CC=C(C=C1)N(CC2=NCCN2)C3=CC(O)=CC=C3

InChI

InChIKey=TUEJFGFQYKDAPM-UHFFFAOYSA-N
InChI=1S/C17H19N3O.ClH/c1-13-5-7-14(8-6-13)20(12-17-18-9-10-19-17)15-3-2-4-16(21)11-15;/h2-8,11,21H,9-10,12H2,1H3,(H,18,19);1H

HIDE SMILES / InChI

Molecular Formula C17H19N3O
Molecular Weight 281.3523
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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:02:23 UTC 2023
Edited
by admin
on Fri Dec 15 15:02:23 UTC 2023
Record UNII
86DRW83R1H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHENTOLAMINE HYDROCHLORIDE
MI   USP-RS   WHO-DD  
Common Name English
Phentolamine hydrochloride [WHO-DD]
Common Name English
PHENOL, 3-(((4,5-DIHYDRO-1H-IMIDAZOL-2-YL)METHYL)(4-METHYLPHENYL)AMINO)-, HYDROCHLORIDE (1:1)
Systematic Name English
M-(N-(2-IMIDAZOLIN-2-YLMETHYL)-P-TOLUIDINO)PHENOL MONOHYDROCHLORIDE
Common Name English
PHENTOLAMINE HYDROCHLORIDE [MI]
Common Name English
PHENOL, 3-(((4,5-DIHYDRO-1H-IMIDAZOL-2-YL)METHYL)(4-METHYLPHENYL)AMINO), MONOHYDROCHLORIDE
Common Name English
PHENTOLAMINE HCL
Common Name English
NSC-757431
Code English
Classification Tree Code System Code
NCI_THESAURUS C29713
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
Code System Code Type Description
CAS
73-05-2
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
PRIMARY
SMS_ID
100000086574
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
PRIMARY
ChEMBL
CHEMBL597
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
PRIMARY
ECHA (EC/EINECS)
200-793-5
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
PRIMARY
NSC
757431
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
PRIMARY
PUBCHEM
657359
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
PRIMARY
EPA CompTox
DTXSID40223271
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
PRIMARY
FDA UNII
86DRW83R1H
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
PRIMARY
NCI_THESAURUS
C80007
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
PRIMARY
EVMPD
SUB22729
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
PRIMARY
MERCK INDEX
m8646
Created by admin on Fri Dec 15 15:02:23 UTC 2023 , Edited by admin on Fri Dec 15 15:02:23 UTC 2023
PRIMARY Merck Index
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