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Details

Stereochemistry ACHIRAL
Molecular Formula C17H15ClN2
Molecular Weight 282.767
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-(3-CHLOROPHENYL)-3-(4-(DIMETHYLAMINO)PHENYL)ACRYLONITRILE

SMILES

CN(C)C1=CC=C(C=C1)\C=C(/C#N)C2=CC(Cl)=CC=C2

InChI

InChIKey=QMQIRPOOHNVHLU-XNTDXEJSSA-N
InChI=1S/C17H15ClN2/c1-20(2)17-8-6-13(7-9-17)10-15(12-19)14-4-3-5-16(18)11-14/h3-11H,1-2H3/b15-10+

HIDE SMILES / InChI

Molecular Formula C17H15ClN2
Molecular Weight 282.767
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 Sat Dec 16 12:48:52 GMT 2023
Edited
by admin
on Sat Dec 16 12:48:52 GMT 2023
Record UNII
R7DA4ERA6A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(3-CHLOROPHENYL)-3-(4-(DIMETHYLAMINO)PHENYL)ACRYLONITRILE
Systematic Name English
BENZENEACETONITRILE, 3-CHLORO-.ALPHA.-((4-(DIMETHYLAMINO)PHENYL)METHYLENE)-
Systematic Name English
NSC-405102
Code English
3-CHLORO-.ALPHA.-((4-(DIMETHYLAMINO)PHENYL)METHYLENE)BENZENEACETONITRILE
Systematic Name English
Code System Code Type Description
CAS
94574-89-7
Created by admin on Sat Dec 16 12:48:52 GMT 2023 , Edited by admin on Sat Dec 16 12:48:52 GMT 2023
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PUBCHEM
5858764
Created by admin on Sat Dec 16 12:48:52 GMT 2023 , Edited by admin on Sat Dec 16 12:48:52 GMT 2023
PRIMARY
NSC
405102
Created by admin on Sat Dec 16 12:48:52 GMT 2023 , Edited by admin on Sat Dec 16 12:48:52 GMT 2023
PRIMARY
FDA UNII
R7DA4ERA6A
Created by admin on Sat Dec 16 12:48:52 GMT 2023 , Edited by admin on Sat Dec 16 12:48:52 GMT 2023
PRIMARY
CHEMBL
2030542
Created by admin on Sat Dec 16 12:48:52 GMT 2023 , Edited by admin on Sat Dec 16 12:48:52 GMT 2023
PRIMARY