[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(3,5-dimethoxyphenyl)propanoate

Systemtic Name: [2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-(3,5-dimethoxyphenyl)propanoate Openeye Name: [2-(3,4-dimethoxyanilino)-2-oxo-ethyl] 3-(3,5-dimethoxyphenyl)propanoate CAS Name: 3-(3,5-dimethoxyphenyl)propanoic acid [2-(3,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethoxyanilino)-2-oxoethyl] 3-(3,5-dimethoxyphenyl)propanoate Traditional Name: 3-(3,5-dimethoxyphenyl)propionic acid [2-(3,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C21H25NO7 MolecularWeight: 403.4257

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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