CAS Registry Number 17380-18-6
Name:
1H-?Indole-?5-?carbonitrile, 3-?formyl-
Indole-5-carbonitrile, 3-formyl- (8CI)
3-Formyl-1H-indole-5-carbonitrile
3-Formyl-5-cyano-1H-indole
5-Cyanoindole-3-carboxaldehyde

Chemical Formula: C10H6N2O
Exact Mass: 170.05
Molecular Weight: 170.17
m/z: 170.05 (100.0%), 171.05 (11.7%)

InChI:InChI=1S/C10H6N2O/c11-4-7-1-2-10-9(3-7)8(6-13)5-12-10/h1-3,5-6,12H

InChI Key:NVBCFOQYDFKXJJ-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1C#N)C(=CN2)C=O

Specification

98%

(4) Xu, Hui; Chemical Biology & Drug Design 2011, V78(5), P864-868 CAPLUS