(E)-7-[4-(4-fluorophenyl)-6-methyl-2-propan-2-yl-pyridin-3-yl]-5-oxidanyl-3-oxidanylidene-hept-6-enoic acid

Systemtic Name: (E)-7-[4-(4-fluorophenyl)-6-methyl-2-propan-2-yl-pyridin-3-yl]-5-oxidanyl-3-oxidanylidene-hept-6-enoic acid Openeye Name: (E)-7-[4-(4-fluorophenyl)-2-isopropyl-6-methyl-3-pyridyl]-5-hydroxy-3-oxo-hept-6-enoic acid CAS Name: (E)-7-[4-(4-fluorophenyl)-6-methyl-2-propan-2-yl-3-pyridinyl]-5-hydroxy-3-oxo-6-heptenoic acid IUPAC Name: (E)-7-[4-(4-fluorophenyl)-6-methyl-2-propan-2-ylpyridin-3-yl]-5-hydroxy-3-oxohept-6-enoic acid Traditional Name: (E)-7-[4-(4-fluorophenyl)-2-isopropyl-6-methyl-3-pyridyl]-5-hydroxy-3-keto-hept-6-enoic acid Formula: C22H24FNO4 MolecularWeight: 385.428663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C2=CC=C(C=C2)F)C=CC(CC(=O)CC(=O)O)O)C(C)C

Isomeric SMILES

CC1=NC(=C(C(=C1)C2=CC=C(C=C2)F)/C=C/C(CC(=O)CC(=O)O)O)C(C)C

InChI

InChI=1S/C22H24FNO4/c1-13(2)22-19(9-8-17(25)11-18(26)12-21(27)28)20(10-14(3)24-22)15-4-6-16(23)7-5-15/h4-10,13,17,25H,11-12H2,1-3H3,(H,27,28)/b9-8+