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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]-N-piperonyl-2-(trifluoromethyl)benzenesulfonamide Formula: C26H21F3N2O5S MolecularWeight: 530.51555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC=C5C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC=C5C(F)(F)F

InChI

InChI=1S/C26H21F3N2O5S/c1-16-6-8-18-12-19(25(32)30-21(18)10-16)14-31(13-17-7-9-22-23(11-17)36-15-35-22)37(33,34)24-5-3-2-4-20(24)26(27,28)29/h2-12H,13-15H2,1H3,(H,30,32)