[2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoate

Systemtic Name: [2-[(4-methyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoate Openeye Name: [2-(4-methyl-2-nitro-anilino)-2-oxo-ethyl] (E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-2-propenoic acid [2-(4-methyl-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-2-nitroanilino)-2-oxoethyl] (E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)acrylic acid [2-keto-2-(4-methyl-2-nitro-anilino)ethyl] ester Formula: C19H17BrN2O6 MolecularWeight: 449.25208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)C=CC2=C(C=CC(=C2)Br)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrN2O6/c1-12-3-6-15(16(9-12)22(25)26)21-18(23)11-28-19(24)8-4-13-10-14(20)5-7-17(13)27-2/h3-10H,11H2,1-2H3,(H,21,23)/b8-4+