6-chloranyl-7-(4-chlorophenyl)sulfanyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid

Systemtic Name: 6-chloranyl-7-(4-chlorophenyl)sulfanyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Openeye Name: 6-chloro-7-(4-chlorophenyl)sulfanyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid CAS Name: 6-chloro-7-[(4-chlorophenyl)thio]-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-chloro-7-(4-chlorophenyl)sulfanyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Traditional Name: 6-chloro-7-[(4-chlorophenyl)thio]-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Formula: C17H9Cl2F3O3S MolecularWeight: 421.21777

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC2=C(C=C3C=C(C(OC3=C2)C(F)(F)F)C(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1SC2=C(C=C3C=C(C(OC3=C2)C(F)(F)F)C(=O)O)Cl)Cl

InChI

InChI=1S/C17H9Cl2F3O3S/c18-9-1-3-10(4-2-9)26-14-7-13-8(6-12(14)19)5-11(16(23)24)15(25-13)17(20,21)22/h1-7,15H,(H,23,24)