[2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-(2-methoxyphenoxy)propanoate

Systemtic Name: [2-[(5-methoxy-2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-(2-methoxyphenoxy)propanoate Openeye Name: [2-(5-methoxy-2-methyl-4-nitro-anilino)-2-oxo-ethyl] 3-(2-methoxyphenoxy)propanoate CAS Name: 3-(2-methoxyphenoxy)propanoic acid [2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-methoxy-2-methyl-4-nitroanilino)-2-oxoethyl] 3-(2-methoxyphenoxy)propanoate Traditional Name: 3-(2-methoxyphenoxy)propionic acid [2-keto-2-(5-methoxy-2-methyl-4-nitro-anilino)ethyl] ester Formula: C20H22N2O8 MolecularWeight: 418.39728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)COC(=O)CCOC2=CC=CC=C2OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)COC(=O)CCOC2=CC=CC=C2OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O8/c1-13-10-15(22(25)26)18(28-3)11-14(13)21-19(23)12-30-20(24)8-9-29-17-7-5-4-6-16(17)27-2/h4-7,10-11H,8-9,12H2,1-3H3,(H,21,23)