[2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(3,5-dimethoxyphenyl)propanoate

Systemtic Name: [2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(3,5-dimethoxyphenyl)propanoate Openeye Name: [2-(2,5-dimethoxyanilino)-2-oxo-ethyl] 3-(3,5-dimethoxyphenyl)propanoate CAS Name: 3-(3,5-dimethoxyphenyl)propanoic acid [2-(2,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethoxyanilino)-2-oxoethyl] 3-(3,5-dimethoxyphenyl)propanoate Traditional Name: 3-(3,5-dimethoxyphenyl)propionic acid [2-(2,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C21H25NO7 MolecularWeight: 403.4257

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)COC(=O)CCC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)COC(=O)CCC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C21H25NO7/c1-25-15-6-7-19(28-4)18(12-15)22-20(23)13-29-21(24)8-5-14-9-16(26-2)11-17(10-14)27-3/h6-7,9-12H,5,8,13H2,1-4H3,(H,22,23)