2-(2-methylphenyl)-3-(3-nitrophenyl)-3-oxidanylidene-propanenitrile

Systemtic Name: 2-(2-methylphenyl)-3-(3-nitrophenyl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(3-nitrophenyl)-2-(o-tolyl)-3-oxo-propanenitrile CAS Name: 2-(2-methylphenyl)-3-(3-nitrophenyl)-3-oxopropanenitrile IUPAC Name: 2-(2-methylphenyl)-3-(3-nitrophenyl)-3-oxopropanenitrile Traditional Name: 3-keto-3-(3-nitrophenyl)-2-(o-tolyl)propionitrile Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C#N)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(C#N)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O3/c1-11-5-2-3-8-14(11)15(10-17)16(19)12-6-4-7-13(9-12)18(20)21/h2-9,15H,1H3