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

Systemtic Name: 2-[3-[[4-[(4-cyanophenyl)methylcarbamoylamino]piperidin-1-yl]methyl]-4-phenyl-pyrrolidin-1-yl]-2-cyclohexyl-ethanoic acid Openeye Name: 2-[3-[[4-[(4-cyanophenyl)methylcarbamoylamino]-1-piperidyl]methyl]-4-phenyl-pyrrolidin-1-yl]-2-cyclohexyl-acetic acid CAS Name: 2-[3-[[4-[[[(4-cyanophenyl)methylamino]-oxomethyl]amino]-1-piperidinyl]methyl]-4-phenyl-1-pyrrolidinyl]-2-cyclohexylacetic acid IUPAC Name: 2-[3-[[4-[(4-cyanophenyl)methylcarbamoylamino]piperidin-1-yl]methyl]-4-phenylpyrrolidin-1-yl]-2-cyclohexylacetic acid Traditional Name: 2-[3-[[4-[(4-cyanobenzyl)carbamoylamino]piperidino]methyl]-4-phenyl-pyrrolidino]-2-cyclohexyl-acetic acid Formula: C33H43N5O3 MolecularWeight: 557.72622

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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)NC(=O)NCC5=CC=C(C=C5)C#N

Isomeric SMILES

C1CCC(CC1)C(C(=O)O)N2CC(C(C2)C3=CC=CC=C3)CN4CCC(CC4)NC(=O)NCC5=CC=C(C=C5)C#N

InChI

InChI=1S/C33H43N5O3/c34-19-24-11-13-25(14-12-24)20-35-33(41)36-29-15-17-37(18-16-29)21-28-22-38(23-30(28)26-7-3-1-4-8-26)31(32(39)40)27-9-5-2-6-10-27/h1,3-4,7-8,11-14,27-31H,2,5-6,9-10,15-18,20-23H2,(H,39,40)(H2,35,36,41)