4-cyclohexyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzenesulfonamide

Systemtic Name: 4-cyclohexyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzenesulfonamide Openeye Name: 4-cyclohexyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzenesulfonamide CAS Name: 4-cyclohexyl-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]benzenesulfonamide IUPAC Name: 4-cyclohexyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]benzenesulfonamide Traditional Name: 4-cyclohexyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzenesulfonamide Formula: C22H30N3O3S+ MolecularWeight: 416.5569

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

InChI

InChI=1S/C22H29N3O3S/c26-29(27,21-9-7-20(8-10-21)19-4-2-1-3-5-19)24-17-18-6-11-22(23-16-18)25-12-14-28-15-13-25/h6-11,16,19,24H,1-5,12-15,17H2/p+1