N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3,4-dimethoxy-N-(4-methylphenyl)benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3,4-dimethoxy-N-(4-methylphenyl)benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-3,4-dimethoxy-N-(p-tolyl)benzenesulfonamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-3,4-dimethoxy-N-(4-methylphenyl)benzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-3,4-dimethoxy-N-(4-methylphenyl)benzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-3,4-dimethoxy-N-(p-tolyl)benzenesulfonamide Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)N2CCCCCC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)N2CCCCCC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H30N2O5S/c1-18-8-10-19(11-9-18)25(17-23(26)24-14-6-4-5-7-15-24)31(27,28)20-12-13-21(29-2)22(16-20)30-3/h8-13,16H,4-7,14-15,17H2,1-3H3