(2-oxidanylidene-4-propan-2-yl-chromen-7-yl) 3,4-bis(fluoranyl)benzenesulfonate

Systemtic Name: (2-oxidanylidene-4-propan-2-yl-chromen-7-yl) 3,4-bis(fluoranyl)benzenesulfonate Openeye Name: (4-isopropyl-2-oxo-chromen-7-yl) 3,4-difluorobenzenesulfonate CAS Name: 3,4-difluorobenzenesulfonic acid (2-oxo-4-propan-2-yl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-propan-2-ylchromen-7-yl) 3,4-difluorobenzenesulfonate Traditional Name: 3,4-difluorobenzenesulfonic acid (4-isopropyl-2-keto-chromen-7-yl) ester Formula: C18H14F2O5S MolecularWeight: 380.362566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=CC(=C(C=C3)F)F

Isomeric SMILES

CC(C)C1=CC(=O)OC2=C1C=CC(=C2)OS(=O)(=O)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C18H14F2O5S/c1-10(2)14-9-18(21)24-17-7-11(3-5-13(14)17)25-26(22,23)12-4-6-15(19)16(20)8-12/h3-10H,1-2H3