N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-hydroxyethyl)-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-(2-hydroxyethyl)-N-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C21H21F3N2O4S MolecularWeight: 454.46265

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CCO)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CCO)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C

InChI

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