N-[4-(5-chloranyl-2-oxidanyl-phenyl)-2-oxidanylidene-6-(trifluoromethyl)-1H-quinolin-3-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[4-(5-chloranyl-2-oxidanyl-phenyl)-2-oxidanylidene-6-(trifluoromethyl)-1H-quinolin-3-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[4-(5-chloro-2-hydroxy-phenyl)-2-oxo-6-(trifluoromethyl)-1H-quinolin-3-yl]-4-nitro-benzenesulfonamide CAS Name: N-[4-(5-chloro-2-hydroxyphenyl)-2-oxo-6-(trifluoromethyl)-1H-quinolin-3-yl]-4-nitrobenzenesulfonamide IUPAC Name: N-[4-(5-chloro-2-hydroxyphenyl)-2-oxo-6-(trifluoromethyl)-1H-quinolin-3-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[4-(5-chloro-2-hydroxy-phenyl)-2-keto-6-(trifluoromethyl)-1H-quinolin-3-yl]-4-nitro-benzenesulfonamide Formula: C22H13ClF3N3O6S MolecularWeight: 539.86833

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)NC2=C(C3=C(C=CC(=C3)C(F)(F)F)NC2=O)C4=C(C=CC(=C4)Cl)O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)NC2=C(C3=C(C=CC(=C3)C(F)(F)F)NC2=O)C4=C(C=CC(=C4)Cl)O

InChI

InChI=1S/C22H13ClF3N3O6S/c23-12-2-8-18(30)16(10-12)19-15-9-11(22(24,25)26)1-7-17(15)27-21(31)20(19)28-36(34,35)14-5-3-13(4-6-14)29(32)33/h1-10,28,30H,(H,27,31)