methyl 5-methyl-5-[4-oxidanyl-3-(trifluoromethyl)phenyl]hexanoate

Systemtic Name: methyl 5-methyl-5-[4-oxidanyl-3-(trifluoromethyl)phenyl]hexanoate Openeye Name: methyl 5-[4-hydroxy-3-(trifluoromethyl)phenyl]-5-methyl-hexanoate CAS Name: 5-[4-hydroxy-3-(trifluoromethyl)phenyl]-5-methylhexanoic acid methyl ester IUPAC Name: methyl 5-[4-hydroxy-3-(trifluoromethyl)phenyl]-5-methylhexanoate Traditional Name: 5-[4-hydroxy-3-(trifluoromethyl)phenyl]-5-methyl-hexanoic acid methyl ester Formula: C15H19F3O3 MolecularWeight: 304.30477

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19F3O3/c1-14(2,8-4-5-13(20)21-3)10-6-7-12(19)11(9-10)15(16,17)18/h6-7,9,19H,4-5,8H2,1-3H3