methyl 4-[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-(3-acetylanilino)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-(3-acetylanilino)-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-(3-acetylanilino)-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-(3-acetylanilino)-2-keto-ethoxy]-3-nitro-benzoic acid methyl ester Formula: C18H16N2O7 MolecularWeight: 372.32884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O7/c1-11(21)12-4-3-5-14(8-12)19-17(22)10-27-16-7-6-13(18(23)26-2)9-15(16)20(24)25/h3-9H,10H2,1-2H3,(H,19,22)