5-methyl-5-[3-(2-methyl-6-oxidanyl-6-oxidanylidene-hexan-2-yl)-2-oxidanyl-phenyl]hexanoic acid

Systemtic Name: 5-methyl-5-[3-(2-methyl-6-oxidanyl-6-oxidanylidene-hexan-2-yl)-2-oxidanyl-phenyl]hexanoic acid Openeye Name: 5-[2-hydroxy-3-(5-hydroxy-1,1-dimethyl-5-oxo-pentyl)phenyl]-5-methyl-hexanoic acid CAS Name: 5-[2-hydroxy-3-(6-hydroxy-2-methyl-6-oxohexan-2-yl)phenyl]-5-methylhexanoic acid IUPAC Name: 5-[2-hydroxy-3-(6-hydroxy-2-methyl-6-oxohexan-2-yl)phenyl]-5-methylhexanoic acid Traditional Name: 5-[2-hydroxy-3-(5-hydroxy-5-keto-1,1-dimethyl-pentyl)phenyl]-5-methyl-hexanoic acid Formula: C20H30O5 MolecularWeight: 350.4492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(=O)O)C1=C(C(=CC=C1)C(C)(C)CCCC(=O)O)O

Isomeric SMILES

CC(C)(CCCC(=O)O)C1=C(C(=CC=C1)C(C)(C)CCCC(=O)O)O

InChI

InChI=1S/C20H30O5/c1-19(2,12-6-10-16(21)22)14-8-5-9-15(18(14)25)20(3,4)13-7-11-17(23)24/h5,8-9,25H,6-7,10-13H2,1-4H3,(H,21,22)(H,23,24)