[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 2-methyl-3,5-dinitro-benzoate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 2-methyl-3,5-dinitro-benzoate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 2-methyl-3,5-dinitro-benzoate CAS Name: 2-methyl-3,5-dinitrobenzoic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 2-methyl-3,5-dinitrobenzoate Traditional Name: 2-methyl-3,5-dinitro-benzoic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C17H14N2O7 MolecularWeight: 358.30226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O7/c1-10-3-5-12(6-4-10)16(20)9-26-17(21)14-7-13(18(22)23)8-15(11(14)2)19(24)25/h3-8H,9H2,1-2H3