N-(1,3-benzodioxol-5-ylmethyl)-4-chloranyl-N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloranyl-N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide Traditional Name: 4-chloro-N-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-N-piperonyl-benzenesulfonamide Formula: C26H23ClN2O5S MolecularWeight: 510.98922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=C(C=C5)Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=C(C=C5)Cl)C

InChI

InChI=1S/C26H23ClN2O5S/c1-16-3-5-19-12-20(26(30)28-25(19)17(16)2)14-29(35(31,32)22-8-6-21(27)7-9-22)13-18-4-10-23-24(11-18)34-15-33-23/h3-12H,13-15H2,1-2H3,(H,28,30)