3-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]methyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanylmethyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]methyl]-N,N-dimethyl-benzenesulfonamide Formula: C18H20ClNO4S2 MolecularWeight: 413.9387

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSCC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSCC2=C3C(=CC(=C2)Cl)COCO3

InChI

InChI=1S/C18H20ClNO4S2/c1-20(2)26(21,22)17-5-3-4-13(6-17)10-25-11-15-8-16(19)7-14-9-23-12-24-18(14)15/h3-8H,9-12H2,1-2H3