4-(4-Isoquinolinylcarbonyl)benzonitrile

CAS Registry Number®

1187167-84-5
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CAS Name

4-(4-Isoquinolinylcarbonyl)benzonitrile

Molecular Formula

C17H10N2O

Molecular Mass

258.27

Cite this Page

4-(4-Isoquinolinylcarbonyl)benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1187167-84-5 (retrieved 2024-09-07) (CAS RN: 1187167-84-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H10N2O/c18-9-12-5-7-13(8-6-12)17(20)16-11-19-10-14-3-1-2-4-15(14)16/h1-8,10-11H

InChIKey

InChIKey=KMKIDWDINSQCIP-UHFFFAOYSA-N

SMILES

C(=O)(C=1C2=C(C=NC1)C=CC=C2)C3=CC=C(C#N)C=C3

Canonical SMILES

N#CC1=CC=C(C=C1)C(=O)C2=CN=CC3=CC=CC=C32

Other Names for this Substance

  • Benzonitrile, 4-(4-isoquinolinylcarbonyl)-
  • 4-(4-Isoquinolinylcarbonyl)benzonitrile