3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]benzamide

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]benzamide Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]benzamide CAS Name: 3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]benzamide IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]benzamide Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]benzamide Formula: C23H38N4O4S+2 MolecularWeight: 466.63722

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3(CCCCC3)[NH+]4CCOCC4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3(CCCCC3)[NH+]4CCOCC4

InChI

InChI=1S/C23H36N4O4S/c1-25-10-12-27(13-11-25)32(29,30)21-7-5-6-20(18-21)22(28)24-19-23(8-3-2-4-9-23)26-14-16-31-17-15-26/h5-7,18H,2-4,8-17,19H2,1H3,(H,24,28)/p+2