2-cyclohexyl-2-[3-phenyl-4-[[4-[4-(phenylmethyl)-1,2,3-triazol-2-yl]piperidin-1-yl]methyl]pyrrolidin-1-yl]ethanoic acid

Systemtic Name: 2-cyclohexyl-2-[3-phenyl-4-[[4-[4-(phenylmethyl)-1,2,3-triazol-2-yl]piperidin-1-yl]methyl]pyrrolidin-1-yl]ethanoic acid Openeye Name: 2-[3-[[4-(4-benzyltriazol-2-yl)-1-piperidyl]methyl]-4-phenyl-pyrrolidin-1-yl]-2-cyclohexyl-acetic acid CAS Name: 2-cyclohexyl-2-[3-phenyl-4-[[4-[4-(phenylmethyl)-2-triazolyl]-1-piperidinyl]methyl]-1-pyrrolidinyl]acetic acid IUPAC Name: 2-[3-[[4-(4-benzyltriazol-2-yl)piperidin-1-yl]methyl]-4-phenylpyrrolidin-1-yl]-2-cyclohexylacetic acid Traditional Name: 2-[3-[[4-(4-benzyltriazol-2-yl)piperidino]methyl]-4-phenyl-pyrrolidino]-2-cyclohexyl-acetic acid Formula: C33H43N5O2 MolecularWeight: 541.72682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(=O)O)N2CC(C(C2)C3=CC=CC=C3)CN4CCC(CC4)N5N=CC(=N5)CC6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)C(C(=O)O)N2CC(C(C2)C3=CC=CC=C3)CN4CCC(CC4)N5N=CC(=N5)CC6=CC=CC=C6

InChI

InChI=1S/C33H43N5O2/c39-33(40)32(27-14-8-3-9-15-27)37-23-28(31(24-37)26-12-6-2-7-13-26)22-36-18-16-30(17-19-36)38-34-21-29(35-38)20-25-10-4-1-5-11-25/h1-2,4-7,10-13,21,27-28,30-32H,3,8-9,14-20,22-24H2,(H,39,40)