2-(1-ethylisoquinolin-5-yl)ethanenitrile

Systemtic Name: 2-(1-ethylisoquinolin-5-yl)ethanenitrile Openeye Name: 2-(1-ethyl-5-isoquinolyl)acetonitrile CAS Name: 2-(1-ethyl-5-isoquinolinyl)acetonitrile IUPAC Name: 2-(1-ethylisoquinolin-5-yl)acetonitrile Traditional Name: 2-(1-ethyl-5-isoquinolyl)acetonitrile Formula: C13H12N2 MolecularWeight: 196.24778

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CC2=C1C=CC=C2CC#N

Isomeric SMILES

CCC1=NC=CC2=C1C=CC=C2CC#N

InChI

InChI=1S/C13H12N2/c1-2-13-12-5-3-4-10(6-8-14)11(12)7-9-15-13/h3-5,7,9H,2,6H2,1H3