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

Systemtic Name: 2-methyl-8-(trifluoromethyl)benzo[e][1]benzothiole-4-carboxylic acid Openeye Name: 2-methyl-8-(trifluoromethyl)benzo[e]benzothiophene-4-carboxylic acid CAS Name: 2-methyl-8-(trifluoromethyl)-4-benzo[e][1]benzothiolecarboxylic acid IUPAC Name: 2-methyl-8-(trifluoromethyl)benzo[e][1]benzothiole-4-carboxylic acid Traditional Name: 2-methyl-8-(trifluoromethyl)benzo[e]benzothiophene-4-carboxylic acid Formula: C15H9F3O2S MolecularWeight: 310.29097

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C3C=C(C=CC3=CC(=C2S1)C(=O)O)C(F)(F)F

Isomeric SMILES

CC1=CC2=C3C=C(C=CC3=CC(=C2S1)C(=O)O)C(F)(F)F

InChI

InChI=1S/C15H9F3O2S/c1-7-4-11-10-6-9(15(16,17)18)3-2-8(10)5-12(14(19)20)13(11)21-7/h2-6H,1H3,(H,19,20)