8-[bis(fluoranyl)methoxy]-6-chloranyl-4-oxidanyl-2,3-dihydrothiochromene-4-carboxylic acid

Systemtic Name: 8-[bis(fluoranyl)methoxy]-6-chloranyl-4-oxidanyl-2,3-dihydrothiochromene-4-carboxylic acid Openeye Name: 6-chloro-8-(difluoromethoxy)-4-hydroxy-thiochromane-4-carboxylic acid CAS Name: 6-chloro-8-(difluoromethoxy)-4-hydroxy-2,3-dihydro-1-benzothiopyran-4-carboxylic acid IUPAC Name: 6-chloro-8-(difluoromethoxy)-4-hydroxy-2,3-dihydrothiochromene-4-carboxylic acid Traditional Name: 6-chloro-8-(difluoromethoxy)-4-hydroxy-thiochroman-4-carboxylic acid Formula: C11H9ClF2O4S MolecularWeight: 310.701566

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2C1(C(=O)O)O)Cl)OC(F)F

Isomeric SMILES

C1CSC2=C(C=C(C=C2C1(C(=O)O)O)Cl)OC(F)F

InChI

InChI=1S/C11H9ClF2O4S/c12-5-3-6-8(7(4-5)18-10(13)14)19-2-1-11(6,17)9(15)16/h3-4,10,17H,1-2H2,(H,15,16)