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

Systemtic Name: [1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-phenoxybenzoate Openeye Name: [1-methyl-2-(2-nitroanilino)-2-oxo-ethyl] 2-phenoxybenzoate CAS Name: 2-phenoxybenzoic acid [1-(2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-nitroanilino)-1-oxopropan-2-yl] 2-phenoxybenzoate Traditional Name: 2-phenoxybenzoic acid [2-keto-1-methyl-2-(2-nitroanilino)ethyl] ester Formula: C22H18N2O6 MolecularWeight: 406.38812

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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=C2OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])OC(=O)C2=CC=CC=C2OC3=CC=CC=C3

InChI

InChI=1S/C22H18N2O6/c1-15(21(25)23-18-12-6-7-13-19(18)24(27)28)29-22(26)17-11-5-8-14-20(17)30-16-9-3-2-4-10-16/h2-15H,1H3,(H,23,25)