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

Systemtic Name: (E)-7-[4-(4-fluorophenyl)-2,6-dimethyl-pyridin-3-yl]-5-oxidanyl-3-oxidanylidene-hept-6-enoic acid Openeye Name: (E)-7-[4-(4-fluorophenyl)-2,6-dimethyl-3-pyridyl]-5-hydroxy-3-oxo-hept-6-enoic acid CAS Name: (E)-7-[4-(4-fluorophenyl)-2,6-dimethyl-3-pyridinyl]-5-hydroxy-3-oxo-6-heptenoic acid IUPAC Name: (E)-7-[4-(4-fluorophenyl)-2,6-dimethylpyridin-3-yl]-5-hydroxy-3-oxohept-6-enoic acid Traditional Name: (E)-7-[4-(4-fluorophenyl)-2,6-dimethyl-3-pyridyl]-5-hydroxy-3-keto-hept-6-enoic acid Formula: C20H20FNO4 MolecularWeight: 357.375503

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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

Isomeric SMILES

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

InChI

InChI=1S/C20H20FNO4/c1-12-9-19(14-3-5-15(21)6-4-14)18(13(2)22-12)8-7-16(23)10-17(24)11-20(25)26/h3-9,16,23H,10-11H2,1-2H3,(H,25,26)/b8-7+