3-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfonylmethyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfonylmethyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[[2-(azepan-1-yl)-2-oxo-ethyl]sulfonylmethyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[2-(1-azepanyl)-2-oxoethyl]sulfonylmethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[[2-(azepan-1-yl)-2-oxoethyl]sulfonylmethyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[2-(azepan-1-yl)-2-keto-ethyl]sulfonylmethyl]-N,N-dimethyl-benzenesulfonamide Formula: C17H26N2O5S2 MolecularWeight: 402.52874

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)CS(=O)(=O)CC(=O)N2CCCCCC2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)CS(=O)(=O)CC(=O)N2CCCCCC2

InChI

InChI=1S/C17H26N2O5S2/c1-18(2)26(23,24)16-9-7-8-15(12-16)13-25(21,22)14-17(20)19-10-5-3-4-6-11-19/h7-9,12H,3-6,10-11,13-14H2,1-2H3