N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-mesitylsulfonyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]isonipecotamide Formula: C25H35N4O4S+ MolecularWeight: 487.6348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34N4O4S/c1-18-14-19(2)24(20(3)15-18)34(31,32)29-8-6-22(7-9-29)25(30)27-17-21-4-5-23(26-16-21)28-10-12-33-13-11-28/h4-5,14-16,22H,6-13,17H2,1-3H3,(H,27,30)/p+1