6-chloranyl-7-(4-chlorophenyl)sulfonyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: 6-chloranyl-7-(4-chlorophenyl)sulfonyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 6-chloro-7-(4-chlorophenyl)sulfonyl-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 6-chloro-7-(4-chlorophenyl)sulfonyl-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-chloro-7-(4-chlorophenyl)sulfonyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 6-chloro-7-(4-chlorophenyl)sulfonyl-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C17H11Cl2F3O5S MolecularWeight: 455.23245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=CC(=C(C=C21)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(C(OC2=CC(=C(C=C21)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl)C(F)(F)F)C(=O)O

InChI

InChI=1S/C17H11Cl2F3O5S/c18-9-1-3-10(4-2-9)28(25,26)14-7-13-8(6-12(14)19)5-11(16(23)24)15(27-13)17(20,21)22/h1-4,6-7,11,15H,5H2,(H,23,24)