3-oxidanylidene-2-(phenylmethyl)isoquinoline-4-carbonitrile

Systemtic Name: 3-oxidanylidene-2-(phenylmethyl)isoquinoline-4-carbonitrile Openeye Name: 2-benzyl-3-oxo-isoquinoline-4-carbonitrile CAS Name: 3-oxo-2-(phenylmethyl)-4-isoquinolinecarbonitrile IUPAC Name: 2-benzyl-3-oxoisoquinoline-4-carbonitrile Traditional Name: 2-benzyl-3-keto-isoquinoline-4-carbonitrile Formula: C17H12N2O MolecularWeight: 260.28998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C3C=CC=CC3=C(C2=O)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C3C=CC=CC3=C(C2=O)C#N

InChI

InChI=1S/C17H12N2O/c18-10-16-15-9-5-4-8-14(15)12-19(17(16)20)11-13-6-2-1-3-7-13/h1-9,12H,11H2