methyl 4-[4-[(4-methoxyphenyl)carbonylamino]-3-nitro-phenyl]-3-methyl-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[4-[(4-methoxyphenyl)carbonylamino]-3-nitro-phenyl]-3-methyl-4-oxidanylidene-butanoate Openeye Name: methyl 4-[4-[(4-methoxybenzoyl)amino]-3-nitro-phenyl]-3-methyl-4-oxo-butanoate CAS Name: 4-[4-[[(4-methoxyphenyl)-oxomethyl]amino]-3-nitrophenyl]-3-methyl-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[4-[(4-methoxybenzoyl)amino]-3-nitrophenyl]-3-methyl-4-oxobutanoate Traditional Name: 4-keto-3-methyl-4-[3-nitro-4-(p-anisoylamino)phenyl]butyric acid methyl ester Formula: C20H20N2O7 MolecularWeight: 400.382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O7/c1-12(10-18(23)29-3)19(24)14-6-9-16(17(11-14)22(26)27)21-20(25)13-4-7-15(28-2)8-5-13/h4-9,11-12H,10H2,1-3H3,(H,21,25)