2-(2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)ethanenitrile

Systemtic Name: 2-(2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)ethanenitrile Openeye Name: 2-(2-methyl-1-oxo-4-phenyl-3-isoquinolyl)acetonitrile CAS Name: 2-(2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)acetonitrile IUPAC Name: 2-(2-methyl-1-oxo-4-phenylisoquinolin-3-yl)acetonitrile Traditional Name: 2-(1-keto-2-methyl-4-phenyl-3-isoquinolyl)acetonitrile Formula: C18H14N2O MolecularWeight: 274.31656

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)CC#N

Isomeric SMILES

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)CC#N

InChI

InChI=1S/C18H14N2O/c1-20-16(11-12-19)17(13-7-3-2-4-8-13)14-9-5-6-10-15(14)18(20)21/h2-10H,11H2,1H3