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Details

Stereochemistry ACHIRAL
Molecular Formula C21H30ClN
Molecular Weight 331.923
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 1-[(2E)-3-(3-chloro-4-cyclohexylphenyl)-2-propenyl]hexahydro-1H-Azepine

SMILES

ClC1=CC(=CC=C1C2CCCCC2)\C=C\CN3CCCCCC3

InChI

InChIKey=SSWKIOQXEOLZBE-CMDGGOBGSA-N
InChI=1S/C21H30ClN/c22-21-17-18(9-8-16-23-14-6-1-2-7-15-23)12-13-20(21)19-10-4-3-5-11-19/h8-9,12-13,17,19H,1-7,10-11,14-16H2/b9-8+

HIDE SMILES / InChI

Approval Year

Name Type Language
1-[(2E)-3-(3-chloro-4-cyclohexylphenyl)-2-propenyl]hexahydro-1H-Azepine
Systematic Name English
1H-Azepine, 1-[3-(3-chloro-4-cyclohexylphenyl)-2-propenyl]hexahydro-, (E)-
Systematic Name English
Code System Code Type Description
CAS
139593-07-0
Created by admin on Sat Dec 16 20:00:30 GMT 2023 , Edited by admin on Sat Dec 16 20:00:30 GMT 2023
PRIMARY
PUBCHEM
18435630
Created by admin on Sat Dec 16 20:00:30 GMT 2023 , Edited by admin on Sat Dec 16 20:00:30 GMT 2023
PRIMARY
FDA UNII
TFM995P6X9
Created by admin on Sat Dec 16 20:00:30 GMT 2023 , Edited by admin on Sat Dec 16 20:00:30 GMT 2023
PRIMARY