(3S)-N-(4-chlorophenyl)-3-(fluoranylmethyl)-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-7-sulfonamide

Systemtic Name: (3S)-N-(4-chlorophenyl)-3-(fluoranylmethyl)-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-7-sulfonamide Openeye Name: (3S)-N-(4-chlorophenyl)-3-(fluoromethyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonamide CAS Name: (3S)-N-(4-chlorophenyl)-3-(fluoromethyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonamide IUPAC Name: (3S)-N-(4-chlorophenyl)-3-(fluoromethyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonamide Traditional Name: (3S)-N-(4-chlorophenyl)-3-(fluoromethyl)-1-keto-3,4-dihydro-2H-isoquinoline-7-sulfonamide Formula: C16H14ClFN2O3S MolecularWeight: 368.810363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)C2=C1C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)Cl)CF

Isomeric SMILES

C1[C@H](NC(=O)C2=C1C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)Cl)CF

InChI

InChI=1S/C16H14ClFN2O3S/c17-11-2-4-12(5-3-11)20-24(22,23)14-6-1-10-7-13(9-18)19-16(21)15(10)8-14/h1-6,8,13,20H,7,9H2,(H,19,21)/t13-/m0/s1