2-(trifluoromethyl)-3,4-dihydro-2H-thiochromene-3-carboxylic acid

Systemtic Name: 2-(trifluoromethyl)-3,4-dihydro-2H-thiochromene-3-carboxylic acid Openeye Name: 2-(trifluoromethyl)thiochromane-3-carboxylic acid CAS Name: 2-(trifluoromethyl)-3,4-dihydro-2H-1-benzothiopyran-3-carboxylic acid IUPAC Name: 2-(trifluoromethyl)-3,4-dihydro-2H-thiochromene-3-carboxylic acid Traditional Name: 2-(trifluoromethyl)thiochroman-3-carboxylic acid Formula: C11H9F3O2S MolecularWeight: 262.24817

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(SC2=CC=CC=C21)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(C(SC2=CC=CC=C21)C(F)(F)F)C(=O)O

InChI

InChI=1S/C11H9F3O2S/c12-11(13,14)9-7(10(15)16)5-6-3-1-2-4-8(6)17-9/h1-4,7,9H,5H2,(H,15,16)