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

Systemtic Name: 7-(4-carboxyphenoxy)-6-chloranyl-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 7-(4-carboxyphenoxy)-6-chloro-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 7-(4-carboxyphenoxy)-6-chloro-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 7-(4-carboxyphenoxy)-6-chloro-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 7-(4-carboxyphenoxy)-6-chloro-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C18H12ClF3O6 MolecularWeight: 416.73249

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=CC(=C(C=C21)Cl)OC3=CC=C(C=C3)C(=O)O)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(C(OC2=CC(=C(C=C21)Cl)OC3=CC=C(C=C3)C(=O)O)C(F)(F)F)C(=O)O

InChI

InChI=1S/C18H12ClF3O6/c19-12-6-9-5-11(17(25)26)15(18(20,21)22)28-13(9)7-14(12)27-10-3-1-8(2-4-10)16(23)24/h1-4,6-7,11,15H,5H2,(H,23,24)(H,25,26)