4-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-N-butyl-3-chloranyl-benzenesulfonamide

Systemtic Name: 4-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-N-butyl-3-chloranyl-benzenesulfonamide Openeye Name: 4-[2-(azepan-1-yl)-2-oxo-ethoxy]-N-butyl-3-chloro-benzenesulfonamide CAS Name: 4-[2-(1-azepanyl)-2-oxoethoxy]-N-butyl-3-chlorobenzenesulfonamide IUPAC Name: 4-[2-(azepan-1-yl)-2-oxoethoxy]-N-butyl-3-chlorobenzenesulfonamide Traditional Name: 4-[2-(azepan-1-yl)-2-keto-ethoxy]-N-butyl-3-chloro-benzenesulfonamide Formula: C18H27ClN2O4S MolecularWeight: 402.93598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC(=C(C=C1)OCC(=O)N2CCCCCC2)Cl

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC(=C(C=C1)OCC(=O)N2CCCCCC2)Cl

InChI

InChI=1S/C18H27ClN2O4S/c1-2-3-10-20-26(23,24)15-8-9-17(16(19)13-15)25-14-18(22)21-11-6-4-5-7-12-21/h8-9,13,20H,2-7,10-12,14H2,1H3