7-butan-2-ylsulfanyl-6-chloranyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid

Systemtic Name: 7-butan-2-ylsulfanyl-6-chloranyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Openeye Name: 6-chloro-7-sec-butylsulfanyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid CAS Name: 7-(butan-2-ylthio)-6-chloro-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 7-butan-2-ylsulfanyl-6-chloro-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Traditional Name: 6-chloro-7-(sec-butylthio)-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Formula: C15H14ClF3O3S MolecularWeight: 366.78307

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=C(C=C2C=C(C(OC2=C1)C(F)(F)F)C(=O)O)Cl

Isomeric SMILES

CCC(C)SC1=C(C=C2C=C(C(OC2=C1)C(F)(F)F)C(=O)O)Cl

InChI

InChI=1S/C15H14ClF3O3S/c1-3-7(2)23-12-6-11-8(5-10(12)16)4-9(14(20)21)13(22-11)15(17,18)19/h4-7,13H,3H2,1-2H3,(H,20,21)