4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N,N-dimethyl-benzenesulfonamide Formula: C21H31N3O4S MolecularWeight: 421.55354

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H31N3O4S/c1-22(2)29(27,28)19-9-7-17(8-10-19)20(25)24-15-11-18(12-16-24)21(26)23-13-5-3-4-6-14-23/h7-10,18H,3-6,11-16H2,1-2H3