2-[[3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]piperidin-1-yl]methyl]benzoic acid

Systemtic Name: 2-[[3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]piperidin-1-yl]methyl]benzoic acid Openeye Name: 2-[[3-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]-1-piperidyl]methyl]benzoic acid CAS Name: 2-[[3-[[[1-cyclohexyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]-1-piperidinyl]methyl]benzoic acid IUPAC Name: 2-[[3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]piperidin-1-yl]methyl]benzoic acid Traditional Name: 2-[[3-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]piperidino]methyl]benzoic acid Formula: C31H34N4O4 MolecularWeight: 526.62606

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC4CCCN(C4)CC5=CC=CC=C5C(=O)O)N=C2C6=COC=C6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC4CCCN(C4)CC5=CC=CC=C5C(=O)O)N=C2C6=COC=C6

InChI

InChI=1S/C31H34N4O4/c36-30(32-24-8-6-15-34(19-24)18-22-7-4-5-11-26(22)31(37)38)21-12-13-28-27(17-21)33-29(23-14-16-39-20-23)35(28)25-9-2-1-3-10-25/h4-5,7,11-14,16-17,20,24-25H,1-3,6,8-10,15,18-19H2,(H,32,36)(H,37,38)