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

Systemtic Name: methyl 4-[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 4-[2-(4-methyl-3-nitro-anilino)-2-oxo-ethoxy]benzoate CAS Name: 4-[2-(4-methyl-3-nitroanilino)-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(4-methyl-3-nitroanilino)-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-(4-methyl-3-nitro-anilino)ethoxy]benzoic acid methyl ester Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O6/c1-11-3-6-13(9-15(11)19(22)23)18-16(20)10-25-14-7-4-12(5-8-14)17(21)24-2/h3-9H,10H2,1-2H3,(H,18,20)