(2R)-3-[2-[(3,4-dimethoxyphenyl)methyl]benzimidazol-1-yl]-2-methyl-propanoic acid

Systemtic Name: (2R)-3-[2-[(3,4-dimethoxyphenyl)methyl]benzimidazol-1-yl]-2-methyl-propanoic acid Openeye Name: (2R)-3-[2-[(3,4-dimethoxyphenyl)methyl]benzimidazol-1-yl]-2-methyl-propanoic acid CAS Name: (2R)-3-[2-[(3,4-dimethoxyphenyl)methyl]-1-benzimidazolyl]-2-methylpropanoic acid IUPAC Name: (2R)-3-[2-[(3,4-dimethoxyphenyl)methyl]benzimidazol-1-yl]-2-methylpropanoic acid Traditional Name: (2R)-2-methyl-3-(2-veratrylbenzimidazol-1-yl)propionic acid Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=CC=CC=C2N=C1CC3=CC(=C(C=C3)OC)OC)C(=O)O

Isomeric SMILES

C[C@H](CN1C2=CC=CC=C2N=C1CC3=CC(=C(C=C3)OC)OC)C(=O)O

InChI

InChI=1S/C20H22N2O4/c1-13(20(23)24)12-22-16-7-5-4-6-15(16)21-19(22)11-14-8-9-17(25-2)18(10-14)26-3/h4-10,13H,11-12H2,1-3H3,(H,23,24)/t13-/m1/s1