N-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-(2-hydroxyethyl)-N-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C21H21F3N2O4S MolecularWeight: 454.46265

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCO)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCO)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C

InChI

InChI=1S/C21H21F3N2O4S/c1-13-8-14(2)18-10-15(20(28)25-19(18)9-13)12-26(6-7-27)31(29,30)17-5-3-4-16(11-17)21(22,23)24/h3-5,8-11,27H,6-7,12H2,1-2H3,(H,25,28)