3-(azepan-1-ylcarbonyl)-N-(2-methoxyphenyl)-N,4-dimethyl-benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-(2-methoxyphenyl)-N,4-dimethyl-benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-N,4-dimethyl-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-(2-methoxyphenyl)-N,4-dimethylbenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-N,4-dimethylbenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-(2-methoxyphenyl)-N,4-dimethyl-benzenesulfonamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2OC)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2OC)C(=O)N3CCCCCC3

InChI

InChI=1S/C22H28N2O4S/c1-17-12-13-18(16-19(17)22(25)24-14-8-4-5-9-15-24)29(26,27)23(2)20-10-6-7-11-21(20)28-3/h6-7,10-13,16H,4-5,8-9,14-15H2,1-3H3