4-(2,3-dimethoxyphenyl)-2-[methyl(phenylmethoxycarbonyl)amino]butanoic acid

Systemtic Name: 4-(2,3-dimethoxyphenyl)-2-[methyl(phenylmethoxycarbonyl)amino]butanoic acid Openeye Name: 2-[benzyloxycarbonyl(methyl)amino]-4-(2,3-dimethoxyphenyl)butanoic acid CAS Name: 4-(2,3-dimethoxyphenyl)-2-[methyl(phenylmethoxycarbonyl)amino]butanoic acid IUPAC Name: 4-(2,3-dimethoxyphenyl)-2-[methyl(phenylmethoxycarbonyl)amino]butanoic acid Traditional Name: 2-[carbobenzoxy(methyl)amino]-4-(2,3-dimethoxyphenyl)butyric acid Formula: C21H25NO6 MolecularWeight: 387.4263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(CCC1=C(C(=CC=C1)OC)OC)C(=O)O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CN(C(CCC1=C(C(=CC=C1)OC)OC)C(=O)O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO6/c1-22(21(25)28-14-15-8-5-4-6-9-15)17(20(23)24)13-12-16-10-7-11-18(26-2)19(16)27-3/h4-11,17H,12-14H2,1-3H3,(H,23,24)