N-(1,3-benzodioxol-5-ylmethyl)-4-chloranyl-N-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloranyl-N-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide Traditional Name: 4-chloro-N-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-N-piperonyl-benzenesulfonamide Formula: C25H21ClN2O6S MolecularWeight: 512.96204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H21ClN2O6S/c1-32-20-6-3-17-11-18(25(29)27-22(17)12-20)14-28(35(30,31)21-7-4-19(26)5-8-21)13-16-2-9-23-24(10-16)34-15-33-23/h2-12H,13-15H2,1H3,(H,27,29)