5-chloranyl-4-sulfanylidene-7-(trifluoromethyl)-1H-quinoline-2-carboxylic acid

Systemtic Name: 5-chloranyl-4-sulfanylidene-7-(trifluoromethyl)-1H-quinoline-2-carboxylic acid Openeye Name: 5-chloro-4-thioxo-7-(trifluoromethyl)-1H-quinoline-2-carboxylic acid CAS Name: 5-chloro-4-sulfanylidene-7-(trifluoromethyl)-1H-quinoline-2-carboxylic acid IUPAC Name: 5-chloro-4-sulfanylidene-7-(trifluoromethyl)-1H-quinoline-2-carboxylic acid Traditional Name: 5-chloro-4-thioxo-7-(trifluoromethyl)-1H-quinoline-2-carboxylic acid Formula: C11H5ClF3NO2S MolecularWeight: 307.67611

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=C1NC(=CC2=S)C(=O)O)Cl)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C2=C1NC(=CC2=S)C(=O)O)Cl)C(F)(F)F

InChI

InChI=1S/C11H5ClF3NO2S/c12-5-1-4(11(13,14)15)2-6-9(5)8(19)3-7(16-6)10(17)18/h1-3H,(H,16,19)(H,17,18)