[1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(phenoxymethyl)benzoate

Systemtic Name: [1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(phenoxymethyl)benzoate Openeye Name: [1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] 2-(phenoxymethyl)benzoate CAS Name: 2-(phenoxymethyl)benzoic acid [1-(2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-nitroanilino)-1-oxopropan-2-yl] 2-(phenoxymethyl)benzoate Traditional Name: 2-(phenoxymethyl)benzoic acid [2-keto-1-methyl-2-(2-nitroanilino)ethyl] ester Formula: C23H20N2O6 MolecularWeight: 420.4147

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])OC(=O)C2=CC=CC=C2COC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])OC(=O)C2=CC=CC=C2COC3=CC=CC=C3

InChI

InChI=1S/C23H20N2O6/c1-16(22(26)24-20-13-7-8-14-21(20)25(28)29)31-23(27)19-12-6-5-9-17(19)15-30-18-10-3-2-4-11-18/h2-14,16H,15H2,1H3,(H,24,26)