3-oxidanyl-4-[oxidanyl-[2-[4,4,6,6-tetraethyl-2-(4-fluoranyl-3-methyl-phenyl)cyclohexen-1-yl]ethyl]phosphoryl]butanoic acid

Systemtic Name: 3-oxidanyl-4-[oxidanyl-[2-[4,4,6,6-tetraethyl-2-(4-fluoranyl-3-methyl-phenyl)cyclohexen-1-yl]ethyl]phosphoryl]butanoic acid Openeye Name: 3-hydroxy-4-[hydroxy-[2-[4,4,6,6-tetraethyl-2-(4-fluoro-3-methyl-phenyl)cyclohexen-1-yl]ethyl]phosphoryl]butanoic acid CAS Name: 3-hydroxy-4-[hydroxy-[2-[4,4,6,6-tetraethyl-2-(4-fluoro-3-methylphenyl)-1-cyclohexenyl]ethyl]phosphoryl]butanoic acid IUPAC Name: 3-hydroxy-4-[hydroxy-[2-[4,4,6,6-tetraethyl-2-(4-fluoro-3-methylphenyl)cyclohexen-1-yl]ethyl]phosphoryl]butanoic acid Traditional Name: 3-hydroxy-4-[hydroxy-[2-[4,4,6,6-tetraethyl-2-(4-fluoro-3-methyl-phenyl)cyclohexen-1-yl]ethyl]phosphoryl]butyric acid Formula: C27H42FO5P MolecularWeight: 496.591544

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(=C(C(C1)(CC)CC)CCP(=O)(CC(CC(=O)O)O)O)C2=CC(=C(C=C2)F)C)CC

Isomeric SMILES

CCC1(CC(=C(C(C1)(CC)CC)CCP(=O)(CC(CC(=O)O)O)O)C2=CC(=C(C=C2)F)C)CC

InChI

InChI=1S/C27H42FO5P/c1-6-26(7-2)16-22(20-10-11-24(28)19(5)14-20)23(27(8-3,9-4)18-26)12-13-34(32,33)17-21(29)15-25(30)31/h10-11,14,21,29H,6-9,12-13,15-18H2,1-5H3,(H,30,31)(H,32,33)