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

Systemtic Name: methyl 4-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-(3,4-dimethoxyanilino)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-(3,4-dimethoxyanilino)-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-(3,4-dimethoxyanilino)-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-(3,4-dimethoxyanilino)-2-keto-ethoxy]-3-nitro-benzoic acid methyl ester Formula: C18H18N2O8 MolecularWeight: 390.34412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C18H18N2O8/c1-25-15-7-5-12(9-16(15)26-2)19-17(21)10-28-14-6-4-11(18(22)27-3)8-13(14)20(23)24/h4-9H,10H2,1-3H3,(H,19,21)