2-[3-[[4-(2-ethyl-4-phenethyl-pyrazol-3-yl)piperidin-1-yl]methyl]-4-phenyl-pyrrolidin-1-yl]-3-methyl-butanoic acid

Systemtic Name: 2-[3-[[4-(2-ethyl-4-phenethyl-pyrazol-3-yl)piperidin-1-yl]methyl]-4-phenyl-pyrrolidin-1-yl]-3-methyl-butanoic acid Openeye Name: 2-[3-[[4-(2-ethyl-4-phenethyl-pyrazol-3-yl)-1-piperidyl]methyl]-4-phenyl-pyrrolidin-1-yl]-3-methyl-butanoic acid CAS Name: 2-[3-[[4-(2-ethyl-4-phenethyl-3-pyrazolyl)-1-piperidinyl]methyl]-4-phenyl-1-pyrrolidinyl]-3-methylbutanoic acid IUPAC Name: 2-[3-[[4-(2-ethyl-4-phenethylpyrazol-3-yl)piperidin-1-yl]methyl]-4-phenylpyrrolidin-1-yl]-3-methylbutanoic acid Traditional Name: 2-[3-[[4-(2-ethyl-4-phenethyl-pyrazol-3-yl)piperidino]methyl]-4-phenyl-pyrrolidino]-3-methyl-butyric acid Formula: C34H46N4O2 MolecularWeight: 542.75464

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CCC2=CC=CC=C2)C3CCN(CC3)CC4CN(CC4C5=CC=CC=C5)C(C(C)C)C(=O)O

Isomeric SMILES

CCN1C(=C(C=N1)CCC2=CC=CC=C2)C3CCN(CC3)CC4CN(CC4C5=CC=CC=C5)C(C(C)C)C(=O)O

InChI

InChI=1S/C34H46N4O2/c1-4-38-33(29(21-35-38)16-15-26-11-7-5-8-12-26)28-17-19-36(20-18-28)22-30-23-37(32(25(2)3)34(39)40)24-31(30)27-13-9-6-10-14-27/h5-14,21,25,28,30-32H,4,15-20,22-24H2,1-3H3,(H,39,40)