3-[1-(4-fluorophenyl)-7-oxidanyl-7-oxidanylidene-heptyl]-2,5,6-trimethyl-4-oxidanyl-benzoic acid

Systemtic Name: 3-[1-(4-fluorophenyl)-7-oxidanyl-7-oxidanylidene-heptyl]-2,5,6-trimethyl-4-oxidanyl-benzoic acid Openeye Name: 3-[1-(4-fluorophenyl)-7-hydroxy-7-oxo-heptyl]-4-hydroxy-2,5,6-trimethyl-benzoic acid CAS Name: 3-[1-(4-fluorophenyl)-7-hydroxy-7-oxoheptyl]-4-hydroxy-2,5,6-trimethylbenzoic acid IUPAC Name: 3-[1-(4-fluorophenyl)-7-hydroxy-7-oxoheptyl]-4-hydroxy-2,5,6-trimethylbenzoic acid Traditional Name: 3-[1-(4-fluorophenyl)-7-hydroxy-7-keto-heptyl]-4-hydroxy-2,5,6-trimethyl-benzoic acid Formula: C23H27FO5 MolecularWeight: 402.455883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)O)C(CCCCCC(=O)O)C2=CC=C(C=C2)F)C)C(=O)O

Isomeric SMILES

CC1=C(C(=C(C(=C1C)O)C(CCCCCC(=O)O)C2=CC=C(C=C2)F)C)C(=O)O

InChI

InChI=1S/C23H27FO5/c1-13-14(2)22(27)21(15(3)20(13)23(28)29)18(7-5-4-6-8-19(25)26)16-9-11-17(24)12-10-16/h9-12,18,27H,4-8H2,1-3H3,(H,25,26)(H,28,29)