2-cyclohexyl-2-[3-phenyl-4-[[4-(3-quinoxalin-2-ylpropyl)piperidin-1-yl]methyl]pyrrolidin-1-yl]ethanoic acid

Systemtic Name: 2-cyclohexyl-2-[3-phenyl-4-[[4-(3-quinoxalin-2-ylpropyl)piperidin-1-yl]methyl]pyrrolidin-1-yl]ethanoic acid Openeye Name: 2-cyclohexyl-2-[3-phenyl-4-[[4-(3-quinoxalin-2-ylpropyl)-1-piperidyl]methyl]pyrrolidin-1-yl]acetic acid CAS Name: 2-cyclohexyl-2-[3-phenyl-4-[[4-[3-(2-quinoxalinyl)propyl]-1-piperidinyl]methyl]-1-pyrrolidinyl]acetic acid IUPAC Name: 2-cyclohexyl-2-[3-phenyl-4-[[4-(3-quinoxalin-2-ylpropyl)piperidin-1-yl]methyl]pyrrolidin-1-yl]acetic acid Traditional Name: 2-cyclohexyl-2-[3-phenyl-4-[[4-(3-quinoxalin-2-ylpropyl)piperidino]methyl]pyrrolidino]acetic acid Formula: C35H46N4O2 MolecularWeight: 554.76534

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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)CCCC5=NC6=CC=CC=C6N=C5

Isomeric SMILES

C1CCC(CC1)C(C(=O)O)N2CC(C(C2)C3=CC=CC=C3)CN4CCC(CC4)CCCC5=NC6=CC=CC=C6N=C5

InChI

InChI=1S/C35H46N4O2/c40-35(41)34(28-13-5-2-6-14-28)39-24-29(31(25-39)27-11-3-1-4-12-27)23-38-20-18-26(19-21-38)10-9-15-30-22-36-32-16-7-8-17-33(32)37-30/h1,3-4,7-8,11-12,16-17,22,26,28-29,31,34H,2,5-6,9-10,13-15,18-21,23-25H2,(H,40,41)