N-(1,3-benzodioxol-5-ylmethyl)-4-bromanyl-N-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-bromanyl-N-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide Traditional Name: 4-bromo-N-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]-N-piperonyl-benzenesulfonamide Formula: C25H21BrN2O6S MolecularWeight: 557.41304

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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=C(C=C5)Br

Isomeric SMILES

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

InChI

InChI=1S/C25H21BrN2O6S/c1-32-20-5-8-22-17(12-20)11-18(25(29)27-22)14-28(35(30,31)21-6-3-19(26)4-7-21)13-16-2-9-23-24(10-16)34-15-33-23/h2-12H,13-15H2,1H3,(H,27,29)