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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)OCC(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)OCC(=O)N3CCCCCC3

InChI

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