N-(1,3-benzodioxol-5-ylmethyl)-N-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]-N-piperonyl-3-(trifluoromethyl)benzenesulfonamide Formula: C26H21F3N2O6S MolecularWeight: 546.51495

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C26H21F3N2O6S/c1-35-20-6-7-22-17(11-20)10-18(25(32)30-22)14-31(13-16-5-8-23-24(9-16)37-15-36-23)38(33,34)21-4-2-3-19(12-21)26(27,28)29/h2-12H,13-15H2,1H3,(H,30,32)