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

Systemtic Name: 7-methyl-2-(trifluoromethyl)-3,4-dihydro-2H-thiochromene-3-carboxylic acid Openeye Name: 7-methyl-2-(trifluoromethyl)thiochromane-3-carboxylic acid CAS Name: 7-methyl-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzothiopyran-3-carboxylic acid IUPAC Name: 7-methyl-2-(trifluoromethyl)-3,4-dihydro-2H-thiochromene-3-carboxylic acid Traditional Name: 7-methyl-2-(trifluoromethyl)thiochroman-3-carboxylic acid Formula: C12H11F3O2S MolecularWeight: 276.27475

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(C(S2)C(F)(F)F)C(=O)O)C=C1

Isomeric SMILES

CC1=CC2=C(CC(C(S2)C(F)(F)F)C(=O)O)C=C1

InChI

InChI=1S/C12H11F3O2S/c1-6-2-3-7-5-8(11(16)17)10(12(13,14)15)18-9(7)4-6/h2-4,8,10H,5H2,1H3,(H,16,17)