[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(2-methoxyphenyl)-2-phenyl-prop-2-enoate

Systemtic Name: [2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(2-methoxyphenyl)-2-phenyl-prop-2-enoate Openeye Name: [2-(4-methyl-2-nitro-anilino)-2-oxo-ethyl] (E)-3-(2-methoxyphenyl)-2-phenyl-prop-2-enoate CAS Name: (E)-3-(2-methoxyphenyl)-2-phenyl-2-propenoic acid [2-(4-methyl-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-2-nitroanilino)-2-oxoethyl] (E)-3-(2-methoxyphenyl)-2-phenylprop-2-enoate Traditional Name: (E)-3-(2-methoxyphenyl)-2-phenyl-acrylic acid [2-keto-2-(4-methyl-2-nitro-anilino)ethyl] ester Formula: C25H22N2O6 MolecularWeight: 446.45198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)C(=CC2=CC=CC=C2OC)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)/C(=C/C2=CC=CC=C2OC)/C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H22N2O6/c1-17-12-13-21(22(14-17)27(30)31)26-24(28)16-33-25(29)20(18-8-4-3-5-9-18)15-19-10-6-7-11-23(19)32-2/h3-15H,16H2,1-2H3,(H,26,28)/b20-15+