3-(3-oxidanylidene-1,4-dihydroisoquinolin-2-yl)benzenecarbonitrile

Systemtic Name: 3-(3-oxidanylidene-1,4-dihydroisoquinolin-2-yl)benzenecarbonitrile Openeye Name: 3-(3-oxo-1,4-dihydroisoquinolin-2-yl)benzonitrile CAS Name: 3-(3-oxo-1,4-dihydroisoquinolin-2-yl)benzonitrile IUPAC Name: 3-(3-oxo-1,4-dihydroisoquinolin-2-yl)benzonitrile Traditional Name: 3-(3-keto-1,4-dihydroisoquinolin-2-yl)benzonitrile Formula: C16H12N2O MolecularWeight: 248.27928

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN(C1=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1C2=CC=CC=C2CN(C1=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C16H12N2O/c17-10-12-4-3-7-15(8-12)18-11-14-6-2-1-5-13(14)9-16(18)19/h1-8H,9,11H2