3-(azepan-1-ylcarbonyl)-N-(4-methoxyphenyl)-N-methyl-benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-(4-methoxyphenyl)-N-methyl-benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-(4-methoxyphenyl)-N-methyl-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-(4-methoxyphenyl)-N-methylbenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-(4-methoxyphenyl)-N-methylbenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-(4-methoxyphenyl)-N-methyl-benzenesulfonamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCCCC3

Isomeric SMILES

CN(C1=CC=C(C=C1)OC)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H26N2O4S/c1-22(18-10-12-19(27-2)13-11-18)28(25,26)20-9-7-8-17(16-20)21(24)23-14-5-3-4-6-15-23/h7-13,16H,3-6,14-15H2,1-2H3