2-[3-[[4-[5-[(4-ethoxyphenyl)methyl]-2-ethyl-pyrazol-3-yl]piperidin-1-yl]methyl]-4-(3-fluorophenyl)pyrrolidin-1-yl]-3-ethyl-pentanoic acid

Systemtic Name: 2-[3-[[4-[5-[(4-ethoxyphenyl)methyl]-2-ethyl-pyrazol-3-yl]piperidin-1-yl]methyl]-4-(3-fluorophenyl)pyrrolidin-1-yl]-3-ethyl-pentanoic acid Openeye Name: 2-[3-[[4-[5-[(4-ethoxyphenyl)methyl]-2-ethyl-pyrazol-3-yl]-1-piperidyl]methyl]-4-(3-fluorophenyl)pyrrolidin-1-yl]-3-ethyl-pentanoic acid CAS Name: 2-[3-[[4-[5-[(4-ethoxyphenyl)methyl]-2-ethyl-3-pyrazolyl]-1-piperidinyl]methyl]-4-(3-fluorophenyl)-1-pyrrolidinyl]-3-ethylpentanoic acid IUPAC Name: 2-[3-[[4-[5-[(4-ethoxyphenyl)methyl]-2-ethylpyrazol-3-yl]piperidin-1-yl]methyl]-4-(3-fluorophenyl)pyrrolidin-1-yl]-3-ethylpentanoic acid Traditional Name: 2-[3-[[4-[5-(4-ethoxybenzyl)-2-ethyl-pyrazol-3-yl]piperidino]methyl]-4-(3-fluorophenyl)pyrrolidino]-3-ethyl-valeric acid Formula: C37H51FN4O3 MolecularWeight: 618.824243

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C(=O)O)N1CC(C(C1)C2=CC(=CC=C2)F)CN3CCC(CC3)C4=CC(=NN4CC)CC5=CC=C(C=C5)OCC

Isomeric SMILES

CCC(CC)C(C(=O)O)N1CC(C(C1)C2=CC(=CC=C2)F)CN3CCC(CC3)C4=CC(=NN4CC)CC5=CC=C(C=C5)OCC

InChI

InChI=1S/C37H51FN4O3/c1-5-27(6-2)36(37(43)44)41-24-30(34(25-41)29-10-9-11-31(38)21-29)23-40-18-16-28(17-19-40)35-22-32(39-42(35)7-3)20-26-12-14-33(15-13-26)45-8-4/h9-15,21-22,27-28,30,34,36H,5-8,16-20,23-25H2,1-4H3,(H,43,44)