(3S)-3-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)propanoic acid

Systemtic Name: (3S)-3-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)propanoic acid Openeye Name: (3S)-3-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)propanoic acid CAS Name: (3S)-3-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)propanoic acid IUPAC Name: (3S)-3-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)propanoic acid Traditional Name: (3S)-3-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)propionic acid Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=O)O)C2=NC3=CC=CC=C3N2

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CC(=O)O)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C17H16N2O3/c1-22-12-8-6-11(7-9-12)13(10-16(20)21)17-18-14-4-2-3-5-15(14)19-17/h2-9,13H,10H2,1H3,(H,18,19)(H,20,21)/t13-/m0/s1