3-[bis(fluoranyl)methyl]-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-7-sulfonyl chloride

Systemtic Name: 3-[bis(fluoranyl)methyl]-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-7-sulfonyl chloride Openeye Name: 3-(difluoromethyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonyl chloride CAS Name: 3-(difluoromethyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonyl chloride IUPAC Name: 3-(difluoromethyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonyl chloride Traditional Name: 3-(difluoromethyl)-1-keto-3,4-dihydro-2H-isoquinoline-7-sulfonyl chloride Formula: C10H8ClF2NO3S MolecularWeight: 295.690226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)C2=C1C=CC(=C2)S(=O)(=O)Cl)C(F)F

Isomeric SMILES

C1C(NC(=O)C2=C1C=CC(=C2)S(=O)(=O)Cl)C(F)F

InChI

InChI=1S/C10H8ClF2NO3S/c11-18(16,17)6-2-1-5-3-8(9(12)13)14-10(15)7(5)4-6/h1-2,4,8-9H,3H2,(H,14,15)