[2-[(3,4-dimethoxyphenyl)methylamino]-2-oxidanylidene-ethyl] 2,3,4-trimethoxybenzoate

Systemtic Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxidanylidene-ethyl] 2,3,4-trimethoxybenzoate Openeye Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxo-ethyl] 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(3,4-dimethoxyphenyl)methylamino]-2-oxoethyl] 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid [2-keto-2-(veratrylamino)ethyl] ester Formula: C21H25NO8 MolecularWeight: 419.4251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)COC(=O)C2=C(C(=C(C=C2)OC)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)COC(=O)C2=C(C(=C(C=C2)OC)OC)OC)OC

InChI

InChI=1S/C21H25NO8/c1-25-15-8-6-13(10-17(15)27-3)11-22-18(23)12-30-21(24)14-7-9-16(26-2)20(29-5)19(14)28-4/h6-10H,11-12H2,1-5H3,(H,22,23)