2-cyclohexyl-2-[3-[[4-[5-methyl-3-oxidanylidene-4-(phenylmethyl)-1H-pyrazol-2-yl]piperidin-1-yl]methyl]-4-phenyl-pyrrolidin-1-yl]ethanoic acid

Systemtic Name: 2-cyclohexyl-2-[3-[[4-[5-methyl-3-oxidanylidene-4-(phenylmethyl)-1H-pyrazol-2-yl]piperidin-1-yl]methyl]-4-phenyl-pyrrolidin-1-yl]ethanoic acid Openeye Name: 2-[3-[[4-(4-benzyl-5-methyl-3-oxo-1H-pyrazol-2-yl)-1-piperidyl]methyl]-4-phenyl-pyrrolidin-1-yl]-2-cyclohexyl-acetic acid CAS Name: 2-cyclohexyl-2-[3-[[4-[5-methyl-3-oxo-4-(phenylmethyl)-1H-pyrazol-2-yl]-1-piperidinyl]methyl]-4-phenyl-1-pyrrolidinyl]acetic acid IUPAC Name: 2-[3-[[4-(4-benzyl-5-methyl-3-oxo-1H-pyrazol-2-yl)piperidin-1-yl]methyl]-4-phenylpyrrolidin-1-yl]-2-cyclohexylacetic acid Traditional Name: 2-[3-[[4-(4-benzyl-5-keto-3-methyl-3-pyrazolin-1-yl)piperidino]methyl]-4-phenyl-pyrrolidino]-2-cyclohexyl-acetic acid Formula: C35H46N4O3 MolecularWeight: 570.76474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2CCN(CC2)CC3CN(CC3C4=CC=CC=C4)C(C5CCCCC5)C(=O)O)CC6=CC=CC=C6

Isomeric SMILES

CC1=C(C(=O)N(N1)C2CCN(CC2)CC3CN(CC3C4=CC=CC=C4)C(C5CCCCC5)C(=O)O)CC6=CC=CC=C6

InChI

InChI=1S/C35H46N4O3/c1-25-31(21-26-11-5-2-6-12-26)34(40)39(36-25)30-17-19-37(20-18-30)22-29-23-38(24-32(29)27-13-7-3-8-14-27)33(35(41)42)28-15-9-4-10-16-28/h2-3,5-8,11-14,28-30,32-33,36H,4,9-10,15-24H2,1H3,(H,41,42)