8-(trifluoromethyl)benzo[e][1]benzothiole-4-carboxylic acid

Systemtic Name: 8-(trifluoromethyl)benzo[e][1]benzothiole-4-carboxylic acid Openeye Name: 8-(trifluoromethyl)benzo[e]benzothiophene-4-carboxylic acid CAS Name: 8-(trifluoromethyl)-4-benzo[e][1]benzothiolecarboxylic acid IUPAC Name: 8-(trifluoromethyl)benzo[e][1]benzothiole-4-carboxylic acid Traditional Name: 8-(trifluoromethyl)benzo[e]benzothiophene-4-carboxylic acid Formula: C14H7F3O2S MolecularWeight: 296.26439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C3C=CSC3=C(C=C21)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC2=C3C=CSC3=C(C=C21)C(=O)O)C(F)(F)F

InChI

InChI=1S/C14H7F3O2S/c15-14(16,17)8-2-1-7-5-11(13(18)19)12-9(3-4-20-12)10(7)6-8/h1-6H,(H,18,19)