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Details

Stereochemistry ACHIRAL
Molecular Formula C9H6N2
Molecular Weight 142.1573
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Cyanoindole

SMILES

N#CC1=CNC2=C1C=CC=C2

InChI

InChIKey=CHIFTAQVXHNVRW-UHFFFAOYSA-N
InChI=1S/C9H6N2/c10-5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H

HIDE SMILES / InChI

Molecular Formula C9H6N2
Molecular Weight 142.1573
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 Wed Apr 02 12:08:47 GMT 2025
Edited
by admin
on Wed Apr 02 12:08:47 GMT 2025
Record UNII
5VCD2BB2FU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-24935
Preferred Name English
3-Cyanoindole
Systematic Name English
Indole-3-carbonitrile
Systematic Name English
1H-Indole-3-carbonitrile
Systematic Name English
Code System Code Type Description
CAS
5457-28-3
Created by admin on Wed Apr 02 12:08:47 GMT 2025 , Edited by admin on Wed Apr 02 12:08:47 GMT 2025
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NSC
24935
Created by admin on Wed Apr 02 12:08:47 GMT 2025 , Edited by admin on Wed Apr 02 12:08:47 GMT 2025
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EPA CompTox
DTXSID00282208
Created by admin on Wed Apr 02 12:08:47 GMT 2025 , Edited by admin on Wed Apr 02 12:08:47 GMT 2025
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FDA UNII
5VCD2BB2FU
Created by admin on Wed Apr 02 12:08:47 GMT 2025 , Edited by admin on Wed Apr 02 12:08:47 GMT 2025
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PUBCHEM
230282
Created by admin on Wed Apr 02 12:08:47 GMT 2025 , Edited by admin on Wed Apr 02 12:08:47 GMT 2025
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