heptyl 4-fluoranyl-3-oxidanyl-6-(trifluoromethyl)cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: heptyl 4-fluoranyl-3-oxidanyl-6-(trifluoromethyl)cyclohexa-1,3-diene-1-carboxylate Openeye Name: heptyl 4-fluoro-3-hydroxy-6-(trifluoromethyl)cyclohexa-1,3-diene-1-carboxylate CAS Name: 4-fluoro-3-hydroxy-6-(trifluoromethyl)-1-cyclohexa-1,3-dienecarboxylic acid heptyl ester IUPAC Name: heptyl 4-fluoro-3-hydroxy-6-(trifluoromethyl)cyclohexa-1,3-diene-1-carboxylate Traditional Name: 4-fluoro-3-hydroxy-6-(trifluoromethyl)cyclohexa-1,3-diene-1-carboxylic acid heptyl ester Formula: C15H20F4O3 MolecularWeight: 324.311113

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=CC(=C(CC1C(F)(F)F)F)O

Isomeric SMILES

CCCCCCCOC(=O)C1=CC(=C(CC1C(F)(F)F)F)O

InChI

InChI=1S/C15H20F4O3/c1-2-3-4-5-6-7-22-14(21)10-8-13(20)12(16)9-11(10)15(17,18)19/h8,11,20H,2-7,9H2,1H3