4-morpholin-4-yl-3-nitro-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]benzamide

Systemtic Name: 4-morpholin-4-yl-3-nitro-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]benzamide Openeye Name: 4-morpholino-3-nitro-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]benzamide CAS Name: 4-(4-morpholinyl)-3-nitro-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]benzamide IUPAC Name: 4-morpholin-4-yl-3-nitro-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]benzamide Traditional Name: 4-morpholino-3-nitro-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]benzamide Formula: C23H35N4O4+ MolecularWeight: 431.5484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])[NH+]4CCCCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])[NH+]4CCCCC4

InChI

InChI=1S/C23H34N4O4/c28-22(24-18-23(9-3-1-4-10-23)26-11-5-2-6-12-26)19-7-8-20(21(17-19)27(29)30)25-13-15-31-16-14-25/h7-8,17H,1-6,9-16,18H2,(H,24,28)/p+1