[1-(4-acetamidophenyl)-1-oxidanylidene-propan-2-yl] 2-nitrobenzoate

Systemtic Name: [1-(4-acetamidophenyl)-1-oxidanylidene-propan-2-yl] 2-nitrobenzoate Openeye Name: [2-(4-acetamidophenyl)-1-methyl-2-oxo-ethyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [1-(4-acetamidophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-acetamidophenyl)-1-oxopropan-2-yl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-(4-acetamidophenyl)-2-keto-1-methyl-ethyl] ester Formula: C18H16N2O6 MolecularWeight: 356.32944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)NC(=O)C)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)NC(=O)C)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O6/c1-11(17(22)13-7-9-14(10-8-13)19-12(2)21)26-18(23)15-5-3-4-6-16(15)20(24)25/h3-11H,1-2H3,(H,19,21)