1-methylsulfonyl-N-(2-oxidanylideneazepan-3-yl)piperidine-3-carboxamide

Systemtic Name: 1-methylsulfonyl-N-(2-oxidanylideneazepan-3-yl)piperidine-3-carboxamide Openeye Name: 1-methylsulfonyl-N-(2-oxoazepan-3-yl)piperidine-3-carboxamide CAS Name: 1-methylsulfonyl-N-(2-oxo-3-azepanyl)-3-piperidinecarboxamide IUPAC Name: 1-methylsulfonyl-N-(2-oxoazepan-3-yl)piperidine-3-carboxamide Traditional Name: N-(2-ketoazepan-3-yl)-1-mesyl-nipecotamide Formula: C13H23N3O4S MolecularWeight: 317.40442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC(C1)C(=O)NC2CCCCNC2=O

Isomeric SMILES

CS(=O)(=O)N1CCCC(C1)C(=O)NC2CCCCNC2=O

InChI

InChI=1S/C13H23N3O4S/c1-21(19,20)16-8-4-5-10(9-16)12(17)15-11-6-2-3-7-14-13(11)18/h10-11H,2-9H2,1H3,(H,14,18)(H,15,17)