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

Systemtic Name: 2-(1-phenylisoquinolin-5-yl)ethanenitrile Openeye Name: 2-(1-phenyl-5-isoquinolyl)acetonitrile CAS Name: 2-(1-phenyl-5-isoquinolinyl)acetonitrile IUPAC Name: 2-(1-phenylisoquinolin-5-yl)acetonitrile Traditional Name: 2-(1-phenyl-5-isoquinolyl)acetonitrile Formula: C17H12N2 MolecularWeight: 244.29058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC=CC3=C2C=CC=C3CC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC=CC3=C2C=CC=C3CC#N

InChI

InChI=1S/C17H12N2/c18-11-9-13-7-4-8-16-15(13)10-12-19-17(16)14-5-2-1-3-6-14/h1-8,10,12H,9H2