6,8-bis(chloranyl)-2-(trifluoromethyl)-2H-thiochromene-3-carboxylic acid

Systemtic Name: 6,8-bis(chloranyl)-2-(trifluoromethyl)-2H-thiochromene-3-carboxylic acid Openeye Name: 6,8-dichloro-2-(trifluoromethyl)-2H-thiochromene-3-carboxylic acid CAS Name: 6,8-dichloro-2-(trifluoromethyl)-2H-1-benzothiopyran-3-carboxylic acid IUPAC Name: 6,8-dichloro-2-(trifluoromethyl)-2H-thiochromene-3-carboxylic acid Traditional Name: 6,8-dichloro-2-(trifluoromethyl)-2H-thiochromene-3-carboxylic acid Formula: C11H5Cl2F3O2S MolecularWeight: 329.12241

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C2C=C(C(SC2=C(C=C1Cl)Cl)C(F)(F)F)C(=O)O

Isomeric SMILES

C1=C2C=C(C(SC2=C(C=C1Cl)Cl)C(F)(F)F)C(=O)O

InChI

InChI=1S/C11H5Cl2F3O2S/c12-5-1-4-2-6(10(17)18)9(11(14,15)16)19-8(4)7(13)3-5/h1-3,9H,(H,17,18)