2-[2-[1-[1-(4-methoxyphenyl)ethyl]piperidin-4-yl]carbonylbenzimidazol-1-yl]butanoic acid

Systemtic Name: 2-[2-[1-[1-(4-methoxyphenyl)ethyl]piperidin-4-yl]carbonylbenzimidazol-1-yl]butanoic acid Openeye Name: 2-[2-[1-[1-(4-methoxyphenyl)ethyl]piperidine-4-carbonyl]benzimidazol-1-yl]butanoic acid CAS Name: 2-[2-[[1-[1-(4-methoxyphenyl)ethyl]-4-piperidinyl]-oxomethyl]-1-benzimidazolyl]butanoic acid IUPAC Name: 2-[2-[1-[1-(4-methoxyphenyl)ethyl]piperidine-4-carbonyl]benzimidazol-1-yl]butanoic acid Traditional Name: 2-[2-[1-[1-(4-methoxyphenyl)ethyl]isonipecotoyl]benzimidazol-1-yl]butyric acid Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1C2=CC=CC=C2N=C1C(=O)C3CCN(CC3)C(C)C4=CC=C(C=C4)OC

Isomeric SMILES

CCC(C(=O)O)N1C2=CC=CC=C2N=C1C(=O)C3CCN(CC3)C(C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H31N3O4/c1-4-22(26(31)32)29-23-8-6-5-7-21(23)27-25(29)24(30)19-13-15-28(16-14-19)17(2)18-9-11-20(33-3)12-10-18/h5-12,17,19,22H,4,13-16H2,1-3H3,(H,31,32)