6-bromanyl-8-methoxy-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: 6-bromanyl-8-methoxy-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 6-bromo-8-methoxy-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 6-bromo-8-methoxy-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-bromo-8-methoxy-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 6-bromo-8-methoxy-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C12H10BrF3O4 MolecularWeight: 355.10461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)Br)CC(C(O2)C(F)(F)F)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1)Br)CC(C(O2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C12H10BrF3O4/c1-19-8-4-6(13)2-5-3-7(11(17)18)10(12(14,15)16)20-9(5)8/h2,4,7,10H,3H2,1H3,(H,17,18)