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Details

Stereochemistry ACHIRAL
Molecular Formula C23H21BrClN.ClH
Molecular Weight 463.237
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of (E)-3-(4'-Bromo[1,1'-biphenyl]-4-yl)-3-(4-chlorophenyl)-N,N-dimethylallylamine hydrochloride

SMILES

Cl.CN(C)C\C=C(\C1=CC=C(Cl)C=C1)C2=CC=C(C=C2)C3=CC=C(Br)C=C3

InChI

InChIKey=ADGYXBJHJJGLRM-BUGNPGDCSA-N
InChI=1S/C23H21BrClN.ClH/c1-26(2)16-15-23(20-9-13-22(25)14-10-20)19-5-3-17(4-6-19)18-7-11-21(24)12-8-18;/h3-15H,16H2,1-2H3;1H/b23-15+;

HIDE SMILES / InChI

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 C23H21BrClN
Molecular Weight 426.777
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:23:42 GMT 2025
Edited
by admin
on Wed Apr 02 20:23:42 GMT 2025
Record UNII
BC283H3JQT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(E)-3-(4'-Bromo[1,1'-biphenyl]-4-yl)-3-(4-chlorophenyl)-N,N-dimethylallylamine hydrochloride
Systematic Name English
2-Propen-1-amine, 3-(4?-bromo[1,1?-biphenyl]-4-yl)-3-(4-chlorophenyl)-N,N-dimethyl-, hydrochloride, (E)-
Preferred Name English
Code System Code Type Description
PUBCHEM
44152908
Created by admin on Wed Apr 02 20:23:42 GMT 2025 , Edited by admin on Wed Apr 02 20:23:42 GMT 2025
PRIMARY
FDA UNII
BC283H3JQT
Created by admin on Wed Apr 02 20:23:42 GMT 2025 , Edited by admin on Wed Apr 02 20:23:42 GMT 2025
PRIMARY
CAS
97392-66-0
Created by admin on Wed Apr 02 20:23:42 GMT 2025 , Edited by admin on Wed Apr 02 20:23:42 GMT 2025
PRIMARY
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