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

Systemtic Name: 2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethanenitrile Openeye Name: 4-methyl-3-nitro-benzoyl cyanide CAS Name: 2-(4-methyl-3-nitrophenyl)-2-oxoacetonitrile IUPAC Name: 4-methyl-3-nitrobenzoyl cyanide Traditional Name: 2-keto-2-(4-methyl-3-nitro-phenyl)acetonitrile Formula: C9H6N2O3 MolecularWeight: 190.15554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6N2O3/c1-6-2-3-7(9(12)5-10)4-8(6)11(13)14/h2-4H,1H3