N-[2-(dimethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-[2-(dimethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[2-(dimethylamino)-5-(1-piperidylsulfonyl)phenyl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[2-(dimethylamino)-5-(1-piperidinylsulfonyl)phenyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[2-(dimethylamino)-5-piperidin-1-ylsulfonylphenyl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-[2-(dimethylamino)-5-piperidinosulfonyl-phenyl]-2-morpholin-4-ium-4-yl-acetamide Formula: C19H31N4O4S+ MolecularWeight: 411.53884

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C[NH+]3CCOCC3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C[NH+]3CCOCC3

InChI

InChI=1S/C19H30N4O4S/c1-21(2)18-7-6-16(28(25,26)23-8-4-3-5-9-23)14-17(18)20-19(24)15-22-10-12-27-13-11-22/h6-7,14H,3-5,8-13,15H2,1-2H3,(H,20,24)/p+1