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

Systemtic Name: 3-[[3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]pyrrolidin-1-yl]methyl]benzoic acid Openeye Name: 3-[[3-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]pyrrolidin-1-yl]methyl]benzoic acid CAS Name: 3-[[3-[[[1-cyclohexyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]-1-pyrrolidinyl]methyl]benzoic acid IUPAC Name: 3-[[3-[[1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]pyrrolidin-1-yl]methyl]benzoic acid Traditional Name: 3-[[3-[[1-cyclohexyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]pyrrolidino]methyl]benzoic acid Formula: C30H32N4O4 MolecularWeight: 512.59948

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC4CCN(C4)CC5=CC=CC(=C5)C(=O)O)N=C2C6=COC=C6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC4CCN(C4)CC5=CC=CC(=C5)C(=O)O)N=C2C6=COC=C6

InChI

InChI=1S/C30H32N4O4/c35-29(31-24-11-13-33(18-24)17-20-5-4-6-22(15-20)30(36)37)21-9-10-27-26(16-21)32-28(23-12-14-38-19-23)34(27)25-7-2-1-3-8-25/h4-6,9-10,12,14-16,19,24-25H,1-3,7-8,11,13,17-18H2,(H,31,35)(H,36,37)