(E)-7-[1-cyclohexyl-4-(4-fluorophenyl)-2-propan-2-yl-pyrrol-3-yl]-6-fluoranyl-2-oxidanyl-hept-6-eneperoxoic acid

Systemtic Name: (E)-7-[1-cyclohexyl-4-(4-fluorophenyl)-2-propan-2-yl-pyrrol-3-yl]-6-fluoranyl-2-oxidanyl-hept-6-eneperoxoic acid Openeye Name: (E)-7-[1-cyclohexyl-4-(4-fluorophenyl)-2-isopropyl-pyrrol-3-yl]-6-fluoro-2-hydroxy-hept-6-eneperoxoic acid CAS Name: (E)-7-[1-cyclohexyl-4-(4-fluorophenyl)-2-propan-2-yl-3-pyrrolyl]-6-fluoro-2-hydroxy-6-hepteneperoxoic acid IUPAC Name: (E)-7-[1-cyclohexyl-4-(4-fluorophenyl)-2-propan-2-ylpyrrol-3-yl]-6-fluoro-2-hydroxyhept-6-eneperoxoic acid Traditional Name: (E)-7-[1-cyclohexyl-4-(4-fluorophenyl)-2-isopropyl-pyrrol-3-yl]-6-fluoro-2-hydroxy-hept-6-eneperoxoic acid Formula: C26H33F2NO4 MolecularWeight: 461.541326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CN1C2CCCCC2)C3=CC=C(C=C3)F)C=C(CCCC(C(=O)OO)O)F

Isomeric SMILES

CC(C)C1=C(C(=CN1C2CCCCC2)C3=CC=C(C=C3)F)/C=C(\CCCC(C(=O)OO)O)/F

InChI

InChI=1S/C26H33F2NO4/c1-17(2)25-22(15-20(28)7-6-10-24(30)26(31)33-32)23(18-11-13-19(27)14-12-18)16-29(25)21-8-4-3-5-9-21/h11-17,21,24,30,32H,3-10H2,1-2H3/b20-15+