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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=CC=C1)OC)OC)C(C(=O)O)N(C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C1=C(C(=CC=C1)OC)OC)C(C(=O)O)N(C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H25NO6/c1-14(16-11-8-12-17(26-3)19(16)27-4)18(20(23)24)22(2)21(25)28-13-15-9-6-5-7-10-15/h5-12,14,18H,13H2,1-4H3,(H,23,24)