1-[2,5-bis(chloranyl)phenyl]sulfonyl-N-(2-methyl-2-morpholin-4-yl-butyl)piperidine-4-carboxamide

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]sulfonyl-N-(2-methyl-2-morpholin-4-yl-butyl)piperidine-4-carboxamide Openeye Name: 1-(2,5-dichlorophenyl)sulfonyl-N-(2-methyl-2-morpholino-butyl)piperidine-4-carboxamide CAS Name: 1-(2,5-dichlorophenyl)sulfonyl-N-[2-methyl-2-(4-morpholinyl)butyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,5-dichlorophenyl)sulfonyl-N-(2-methyl-2-morpholin-4-ylbutyl)piperidine-4-carboxamide Traditional Name: 1-(2,5-dichlorophenyl)sulfonyl-N-(2-methyl-2-morpholino-butyl)isonipecotamide Formula: C21H31Cl2N3O4S MolecularWeight: 492.45954

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)Cl)Cl)N3CCOCC3

Isomeric SMILES

CCC(C)(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)Cl)Cl)N3CCOCC3

InChI

InChI=1S/C21H31Cl2N3O4S/c1-3-21(2,25-10-12-30-13-11-25)15-24-20(27)16-6-8-26(9-7-16)31(28,29)19-14-17(22)4-5-18(19)23/h4-5,14,16H,3,6-13,15H2,1-2H3,(H,24,27)