5-[2-(2-ethyl-5-fluoranyl-phenyl)ethyl]-6-methyl-5-oxidanyl-3-oxidanylidene-heptanoic acid

Systemtic Name: 5-[2-(2-ethyl-5-fluoranyl-phenyl)ethyl]-6-methyl-5-oxidanyl-3-oxidanylidene-heptanoic acid Openeye Name: 5-[2-(2-ethyl-5-fluoro-phenyl)ethyl]-5-hydroxy-6-methyl-3-oxo-heptanoic acid CAS Name: 5-[2-(2-ethyl-5-fluorophenyl)ethyl]-5-hydroxy-6-methyl-3-oxoheptanoic acid IUPAC Name: 5-[2-(2-ethyl-5-fluorophenyl)ethyl]-5-hydroxy-6-methyl-3-oxoheptanoic acid Traditional Name: 5-[2-(2-ethyl-5-fluoro-phenyl)ethyl]-5-hydroxy-3-keto-6-methyl-enanthic acid Formula: C18H25FO4 MolecularWeight: 324.387103

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)F)CCC(CC(=O)CC(=O)O)(C(C)C)O

Isomeric SMILES

CCC1=C(C=C(C=C1)F)CCC(CC(=O)CC(=O)O)(C(C)C)O

InChI

InChI=1S/C18H25FO4/c1-4-13-5-6-15(19)9-14(13)7-8-18(23,12(2)3)11-16(20)10-17(21)22/h5-6,9,12,23H,4,7-8,10-11H2,1-3H3,(H,21,22)