3-(4-methyl-3-nitro-phenyl)-3-oxidanylidene-2-phenyl-propanenitrile

Systemtic Name: 3-(4-methyl-3-nitro-phenyl)-3-oxidanylidene-2-phenyl-propanenitrile Openeye Name: 3-(4-methyl-3-nitro-phenyl)-3-oxo-2-phenyl-propanenitrile CAS Name: 3-(4-methyl-3-nitrophenyl)-3-oxo-2-phenylpropanenitrile IUPAC Name: 3-(4-methyl-3-nitrophenyl)-3-oxo-2-phenylpropanenitrile Traditional Name: 3-keto-3-(4-methyl-3-nitro-phenyl)-2-phenyl-propionitrile Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C#N)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(C#N)C2=CC=CC=C2)[N+](=O)[O-]

InChI

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