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6-(trifluoromethyl)-1,3-dihydrobenzo[f][2]benzothiole-8-sulfonic acid

6-(trifluoromethyl)-1,3-dihydrobenzo[f][2]benzothiole-8-sulfonic acid

Systemtic Name:6-(trifluoromethyl)-1,3-dihydrobenzo[f][2]benzothiole-8-sulfonic acid
Openeye Name:6-(trifluoromethyl)-1,3-dihydrobenzo[f][2]benzothiole-8-sulfonic acid
CAS Name:6-(trifluoromethyl)-1,3-dihydrobenzo[f][2]benzothiole-8-sulfonic acid
IUPAC Name:6-(trifluoromethyl)-1,3-dihydrobenzo[f][2]benzothiole-8-sulfonic acid
Traditional Name:6-(trifluoromethyl)-1,3-dihydrobenz[f]isobenzothiophene-8-sulfonic acid
Formula: C13H9F3O3S2
MolecularWeight: 334.33397
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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(CS1)C=C3C(=C2)C=C(C=C3S(=O)(=O)O)C(F)(F)F


Isomeric SMILES

C1C2=C(CS1)C=C3C(=C2)C=C(C=C3S(=O)(=O)O)C(F)(F)F


InChI

InChI=1S/C13H9F3O3S2/c14-13(15,16)10-2-7-1-8-5-20-6-9(8)3-11(7)12(4-10)21(17,18)19/h1-4H,5-6H2,(H,17,18,19)


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