7-(2-oxidanylidenepropoxy)-4-(trifluoromethyl)chromen-2-one

Systemtic Name: 7-(2-oxidanylidenepropoxy)-4-(trifluoromethyl)chromen-2-one Openeye Name: 7-acetonyloxy-4-(trifluoromethyl)chromen-2-one CAS Name: 7-(2-oxopropoxy)-4-(trifluoromethyl)-1-benzopyran-2-one IUPAC Name: 7-(2-oxopropoxy)-4-(trifluoromethyl)chromen-2-one Traditional Name: 7-acetonyloxy-4-(trifluoromethyl)coumarin Formula: C13H9F3O4 MolecularWeight: 286.20337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F

Isomeric SMILES

CC(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F

InChI

InChI=1S/C13H9F3O4/c1-7(17)6-19-8-2-3-9-10(13(14,15)16)5-12(18)20-11(9)4-8/h2-5H,6H2,1H3