4-[4-(trifluoromethyl)phenyl]oxane-4-carboxylic acid

Systemtic Name: 4-[4-(trifluoromethyl)phenyl]oxane-4-carboxylic acid Openeye Name: 4-[4-(trifluoromethyl)phenyl]tetrahydropyran-4-carboxylic acid CAS Name: 4-[4-(trifluoromethyl)phenyl]-4-oxanecarboxylic acid IUPAC Name: 4-[4-(trifluoromethyl)phenyl]oxane-4-carboxylic acid Traditional Name: 4-[4-(trifluoromethyl)phenyl]tetrahydropyran-4-carboxylic acid Formula: C13H13F3O3 MolecularWeight: 274.23573

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C2=CC=C(C=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

C1COCCC1(C2=CC=C(C=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C13H13F3O3/c14-13(15,16)10-3-1-9(2-4-10)12(11(17)18)5-7-19-8-6-12/h1-4H,5-8H2,(H,17,18)