3-(4-methoxyphenyl)-3-[5-(phenylsulfonylamino)benzimidazol-1-yl]propanoic acid

Systemtic Name: 3-(4-methoxyphenyl)-3-[5-(phenylsulfonylamino)benzimidazol-1-yl]propanoic acid Openeye Name: 3-[5-(benzenesulfonamido)benzimidazol-1-yl]-3-(4-methoxyphenyl)propanoic acid CAS Name: 3-[5-(benzenesulfonamido)-1-benzimidazolyl]-3-(4-methoxyphenyl)propanoic acid IUPAC Name: 3-[5-(benzenesulfonamido)benzimidazol-1-yl]-3-(4-methoxyphenyl)propanoic acid Traditional Name: 3-[5-(benzenesulfonamido)benzimidazol-1-yl]-3-(4-methoxyphenyl)propionic acid Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=O)O)N2C=NC3=C2C=CC(=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(CC(=O)O)N2C=NC3=C2C=CC(=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O5S/c1-31-18-10-7-16(8-11-18)22(14-23(27)28)26-15-24-20-13-17(9-12-21(20)26)25-32(29,30)19-5-3-2-4-6-19/h2-13,15,22,25H,14H2,1H3,(H,27,28)