2-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-5-chloranyl-N,N-diethyl-benzenesulfonamide

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-5-chloranyl-N,N-diethyl-benzenesulfonamide Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethoxy]-5-chloro-N,N-diethyl-benzenesulfonamide CAS Name: 2-[2-(1-azepanyl)-2-oxoethoxy]-5-chloro-N,N-diethylbenzenesulfonamide IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethoxy]-5-chloro-N,N-diethylbenzenesulfonamide Traditional Name: 2-[2-(azepan-1-yl)-2-keto-ethoxy]-5-chloro-N,N-diethyl-benzenesulfonamide Formula: C18H27ClN2O4S MolecularWeight: 402.93598

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)Cl)OCC(=O)N2CCCCCC2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)Cl)OCC(=O)N2CCCCCC2

InChI

InChI=1S/C18H27ClN2O4S/c1-3-21(4-2)26(23,24)17-13-15(19)9-10-16(17)25-14-18(22)20-11-7-5-6-8-12-20/h9-10,13H,3-8,11-12,14H2,1-2H3