1-(3,4-dimethylphenyl)sulfonyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]piperidine-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]isonipecotamide Formula: C24H33N4O4S+ MolecularWeight: 473.60822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4)C

InChI

InChI=1S/C24H32N4O4S/c1-18-3-5-22(15-19(18)2)33(30,31)28-9-7-21(8-10-28)24(29)26-17-20-4-6-23(25-16-20)27-11-13-32-14-12-27/h3-6,15-16,21H,7-14,17H2,1-2H3,(H,26,29)/p+1