methyl 4-[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzoate

Systemtic Name: methyl 4-[1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzoate Openeye Name: methyl 4-[1-methyl-2-(3-nitroanilino)-2-oxo-ethoxy]benzoate CAS Name: 4-[1-(3-nitroanilino)-1-oxopropan-2-yl]oxybenzoic acid methyl ester IUPAC Name: methyl 4-[1-(3-nitroanilino)-1-oxopropan-2-yl]oxybenzoate Traditional Name: 4-[2-keto-1-methyl-2-(3-nitroanilino)ethoxy]benzoic acid methyl ester Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])OC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H16N2O6/c1-11(25-15-8-6-12(7-9-15)17(21)24-2)16(20)18-13-4-3-5-14(10-13)19(22)23/h3-11H,1-2H3,(H,18,20)