2-methyl-4-(4-methylphenyl)-1-oxidanylidene-isoquinoline-3-carbonitrile

Systemtic Name: 2-methyl-4-(4-methylphenyl)-1-oxidanylidene-isoquinoline-3-carbonitrile Openeye Name: 2-methyl-1-oxo-4-(p-tolyl)isoquinoline-3-carbonitrile CAS Name: 2-methyl-4-(4-methylphenyl)-1-oxo-3-isoquinolinecarbonitrile IUPAC Name: 2-methyl-4-(4-methylphenyl)-1-oxoisoquinoline-3-carbonitrile Traditional Name: 1-keto-2-methyl-4-(p-tolyl)isoquinoline-3-carbonitrile Formula: C18H14N2O MolecularWeight: 274.31656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N(C(=O)C3=CC=CC=C32)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N(C(=O)C3=CC=CC=C32)C)C#N

InChI

InChI=1S/C18H14N2O/c1-12-7-9-13(10-8-12)17-14-5-3-4-6-15(14)18(21)20(2)16(17)11-19/h3-10H,1-2H3