(E)-7-[4-(4-fluoranyl-3-phenoxy-phenyl)-5-phenyl-1-piperidin-1-yl-2-propan-2-yl-pyrrol-3-yl]-5-oxidanyl-3-oxidanylidene-hept-6-enoic acid

Systemtic Name: (E)-7-[4-(4-fluoranyl-3-phenoxy-phenyl)-5-phenyl-1-piperidin-1-yl-2-propan-2-yl-pyrrol-3-yl]-5-oxidanyl-3-oxidanylidene-hept-6-enoic acid Openeye Name: (E)-7-[4-(4-fluoro-3-phenoxy-phenyl)-2-isopropyl-5-phenyl-1-(1-piperidyl)pyrrol-3-yl]-5-hydroxy-3-oxo-hept-6-enoic acid CAS Name: (E)-7-[4-(4-fluoro-3-phenoxyphenyl)-5-phenyl-1-(1-piperidinyl)-2-propan-2-yl-3-pyrrolyl]-5-hydroxy-3-oxo-6-heptenoic acid IUPAC Name: (E)-7-[4-(4-fluoro-3-phenoxyphenyl)-5-phenyl-1-piperidin-1-yl-2-propan-2-ylpyrrol-3-yl]-5-hydroxy-3-oxohept-6-enoic acid Traditional Name: (E)-7-[4-(4-fluoro-3-phenoxy-phenyl)-2-isopropyl-5-phenyl-1-piperidino-pyrrol-3-yl]-5-hydroxy-3-keto-hept-6-enoic acid Formula: C37H39FN2O5 MolecularWeight: 610.714363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(N1N2CCCCC2)C3=CC=CC=C3)C4=CC(=C(C=C4)F)OC5=CC=CC=C5)C=CC(CC(=O)CC(=O)O)O

Isomeric SMILES

CC(C)C1=C(C(=C(N1N2CCCCC2)C3=CC=CC=C3)C4=CC(=C(C=C4)F)OC5=CC=CC=C5)/C=C/C(CC(=O)CC(=O)O)O

InChI

InChI=1S/C37H39FN2O5/c1-25(2)36-31(18-17-28(41)23-29(42)24-34(43)44)35(27-16-19-32(38)33(22-27)45-30-14-8-4-9-15-30)37(26-12-6-3-7-13-26)40(36)39-20-10-5-11-21-39/h3-4,6-9,12-19,22,25,28,41H,5,10-11,20-21,23-24H2,1-2H3,(H,43,44)/b18-17+