3-[1-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-5-phenyl-pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-5-phenyl-pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-5-phenyl-pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-5-phenyl-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-5-phenylpyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(2-keto-1,3-dihydrobenzimidazol-5-yl)-5-phenyl-pyrrol-2-yl]propionic acid Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(N2C3=CC4=C(C=C3)NC(=O)N4)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(N2C3=CC4=C(C=C3)NC(=O)N4)CCC(=O)O

InChI

InChI=1S/C20H17N3O3/c24-19(25)11-8-14-7-10-18(13-4-2-1-3-5-13)23(14)15-6-9-16-17(12-15)22-20(26)21-16/h1-7,9-10,12H,8,11H2,(H,24,25)(H2,21,22,26)