3-[4-[2-(2-phenylbenzimidazol-1-yl)ethoxy]phenyl]-2-pyrrol-1-yl-propanoic acid

Systemtic Name: 3-[4-[2-(2-phenylbenzimidazol-1-yl)ethoxy]phenyl]-2-pyrrol-1-yl-propanoic acid Openeye Name: 3-[4-[2-(2-phenylbenzimidazol-1-yl)ethoxy]phenyl]-2-pyrrol-1-yl-propanoic acid CAS Name: 3-[4-[2-(2-phenyl-1-benzimidazolyl)ethoxy]phenyl]-2-(1-pyrrolyl)propanoic acid IUPAC Name: 3-[4-[2-(2-phenylbenzimidazol-1-yl)ethoxy]phenyl]-2-pyrrol-1-ylpropanoic acid Traditional Name: 3-[4-[2-(2-phenylbenzimidazol-1-yl)ethoxy]phenyl]-2-pyrrol-1-yl-propionic acid Formula: C28H25N3O3 MolecularWeight: 451.5164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2CCOC4=CC=C(C=C4)CC(C(=O)O)N5C=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2CCOC4=CC=C(C=C4)CC(C(=O)O)N5C=CC=C5

InChI

InChI=1S/C28H25N3O3/c32-28(33)26(30-16-6-7-17-30)20-21-12-14-23(15-13-21)34-19-18-31-25-11-5-4-10-24(25)29-27(31)22-8-2-1-3-9-22/h1-17,26H,18-20H2,(H,32,33)