4-[[(4-methylphenyl)sulfonylamino]methyl]-N-[2-(2-morpholin-4-ium-4-ylethylamino)-2-oxidanylidene-ethyl]cyclohexane-1-carboxamide

Systemtic Name: 4-[[(4-methylphenyl)sulfonylamino]methyl]-N-[2-(2-morpholin-4-ium-4-ylethylamino)-2-oxidanylidene-ethyl]cyclohexane-1-carboxamide Openeye Name: N-[2-(2-morpholin-4-ium-4-ylethylamino)-2-oxo-ethyl]-4-[(p-tolylsulfonylamino)methyl]cyclohexanecarboxamide CAS Name: 4-[[(4-methylphenyl)sulfonylamino]methyl]-N-[2-[2-(4-morpholin-4-iumyl)ethylamino]-2-oxoethyl]-1-cyclohexanecarboxamide IUPAC Name: 4-[[(4-methylphenyl)sulfonylamino]methyl]-N-[2-(2-morpholin-4-ium-4-ylethylamino)-2-oxoethyl]cyclohexane-1-carboxamide Traditional Name: N-[2-keto-2-(2-morpholin-4-ium-4-ylethylamino)ethyl]-4-[(tosylamino)methyl]cyclohexanecarboxamide Formula: C23H37N4O5S+ MolecularWeight: 481.62868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)NCC(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)NCC(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C23H36N4O5S/c1-18-2-8-21(9-3-18)33(30,31)26-16-19-4-6-20(7-5-19)23(29)25-17-22(28)24-10-11-27-12-14-32-15-13-27/h2-3,8-9,19-20,26H,4-7,10-17H2,1H3,(H,24,28)(H,25,29)/p+1