2-[3-[[4-[2-ethyl-5-[[4-[(2-methylpropan-2-yl)oxy]phenyl]methyl]pyrazol-3-yl]piperidin-1-yl]methyl]-4-(3-fluorophenyl)pyrrolidin-1-yl]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[3-[[4-[2-ethyl-5-[[4-[(2-methylpropan-2-yl)oxy]phenyl]methyl]pyrazol-3-yl]piperidin-1-yl]methyl]-4-(3-fluorophenyl)pyrrolidin-1-yl]-3,3-dimethyl-butanoic acid Openeye Name: 2-[3-[[4-[5-[(4-tert-butoxyphenyl)methyl]-2-ethyl-pyrazol-3-yl]-1-piperidyl]methyl]-4-(3-fluorophenyl)pyrrolidin-1-yl]-3,3-dimethyl-butanoic acid CAS Name: 2-[3-[[4-[2-ethyl-5-[[4-[(2-methylpropan-2-yl)oxy]phenyl]methyl]-3-pyrazolyl]-1-piperidinyl]methyl]-4-(3-fluorophenyl)-1-pyrrolidinyl]-3,3-dimethylbutanoic acid IUPAC Name: 2-[3-[[4-[2-ethyl-5-[[4-[(2-methylpropan-2-yl)oxy]phenyl]methyl]pyrazol-3-yl]piperidin-1-yl]methyl]-4-(3-fluorophenyl)pyrrolidin-1-yl]-3,3-dimethylbutanoic acid Traditional Name: 2-[3-[[4-[5-(4-tert-butoxybenzyl)-2-ethyl-pyrazol-3-yl]piperidino]methyl]-4-(3-fluorophenyl)pyrrolidino]-3,3-dimethyl-butyric acid Formula: C38H53FN4O3 MolecularWeight: 632.850823

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)CC2=CC=C(C=C2)OC(C)(C)C)C3CCN(CC3)CC4CN(CC4C5=CC(=CC=C5)F)C(C(=O)O)C(C)(C)C

Isomeric SMILES

CCN1C(=CC(=N1)CC2=CC=C(C=C2)OC(C)(C)C)C3CCN(CC3)CC4CN(CC4C5=CC(=CC=C5)F)C(C(=O)O)C(C)(C)C

InChI

InChI=1S/C38H53FN4O3/c1-8-43-34(22-31(40-43)20-26-12-14-32(15-13-26)46-38(5,6)7)27-16-18-41(19-17-27)23-29-24-42(35(36(44)45)37(2,3)4)25-33(29)28-10-9-11-30(39)21-28/h9-15,21-22,27,29,33,35H,8,16-20,23-25H2,1-7H3,(H,44,45)