N-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]phenyl]-N-methyl-benzenesulfonamide

Systemtic Name: N-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]phenyl]-N-methyl-benzenesulfonamide Openeye Name: N-[4-[2-(azepan-1-yl)-2-oxo-ethoxy]phenyl]-N-methyl-benzenesulfonamide CAS Name: N-[4-[2-(1-azepanyl)-2-oxoethoxy]phenyl]-N-methylbenzenesulfonamide IUPAC Name: N-[4-[2-(azepan-1-yl)-2-oxoethoxy]phenyl]-N-methylbenzenesulfonamide Traditional Name: N-[4-[2-(azepan-1-yl)-2-keto-ethoxy]phenyl]-N-methyl-benzenesulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OCC(=O)N2CCCCCC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C1=CC=C(C=C1)OCC(=O)N2CCCCCC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S/c1-22(28(25,26)20-9-5-4-6-10-20)18-11-13-19(14-12-18)27-17-21(24)23-15-7-2-3-8-16-23/h4-6,9-14H,2-3,7-8,15-17H2,1H3