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Details

Stereochemistry RACEMIC
Molecular Formula C18H20ClNO2.BrH
Molecular Weight 398.722
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SKF-83959 HYDROBROMIDE

SMILES

Br.CN1CCC2=C(C=C(O)C(O)=C2Cl)C(C1)C3=CC(C)=CC=C3

InChI

InChIKey=FHYWNBUFNGHNCP-UHFFFAOYSA-N
InChI=1S/C18H20ClNO2.BrH/c1-11-4-3-5-12(8-11)15-10-20(2)7-6-13-14(15)9-16(21)18(22)17(13)19;/h3-5,8-9,15,21-22H,6-7,10H2,1-2H3;1H

HIDE SMILES / InChI

Approval Year

Unknown
86413
Name Type Language
SKF-83959 HYDROBROMIDE
Common Name English
1H-3-BENZAZEPINE-7,8-DIOL, 6-CHLORO-2,3,4,5-TETRAHYDRO-3-METHYL-1-(3-METHYLPHENYL)-, HYDROBROMIDE
Systematic Name English
1H-3-BENZAZEPINE-7,8-DIOL, 6-CHLORO-2,3,4,5-TETRAHYDRO-3-METHYL-1-(3-METHYLPHENYL)-, HYDROBROMIDE (1:1)
Systematic Name English
6-CHLORO-2,3,4,5-TETRAHYDRO-3-METHYL-1-(3-METHYLPHENYL)-1H-3-BENZAZEPINE-7,8-DIOL HYDROBROMIDE
Systematic Name English
Code System Code Type Description
FDA UNII
7NB1Z2NM8O
Created by admin on Sat Dec 16 10:40:58 UTC 2023 , Edited by admin on Sat Dec 16 10:40:58 UTC 2023
PRIMARY
CAS
67287-95-0
Created by admin on Sat Dec 16 10:40:58 UTC 2023 , Edited by admin on Sat Dec 16 10:40:58 UTC 2023
PRIMARY
EPA CompTox
DTXSID9042629
Created by admin on Sat Dec 16 10:40:58 UTC 2023 , Edited by admin on Sat Dec 16 10:40:58 UTC 2023
PRIMARY
PUBCHEM
11957685
Created by admin on Sat Dec 16 10:40:58 UTC 2023 , Edited by admin on Sat Dec 16 10:40:58 UTC 2023
PRIMARY
ACTIVE MOIETY
Structure of SKF-83959
NIH
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