N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-oxidanylidene-6-(pyrrolidin-1-ium-1-ylmethyl)-1H-pyridine-3-carboxamide

Systemtic Name: N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-oxidanylidene-6-(pyrrolidin-1-ium-1-ylmethyl)-1H-pyridine-3-carboxamide Openeye Name: N-[(1-morpholinocyclohexyl)methyl]-2-oxo-6-(pyrrolidin-1-ium-1-ylmethyl)-1H-pyridine-3-carboxamide CAS Name: N-[[1-(4-morpholinyl)cyclohexyl]methyl]-2-oxo-6-(1-pyrrolidin-1-iumylmethyl)-1H-pyridine-3-carboxamide IUPAC Name: N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-oxo-6-(pyrrolidin-1-ium-1-ylmethyl)-1H-pyridine-3-carboxamide Traditional Name: 2-keto-N-[(1-morpholinocyclohexyl)methyl]-6-(pyrrolidin-1-ium-1-ylmethyl)-1H-pyridine-3-carboxamide Formula: C22H35N4O3+ MolecularWeight: 403.5383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2=CC=C(NC2=O)C[NH+]3CCCC3)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2=CC=C(NC2=O)C[NH+]3CCCC3)N4CCOCC4

InChI

InChI=1S/C22H34N4O3/c27-20(19-7-6-18(24-21(19)28)16-25-10-4-5-11-25)23-17-22(8-2-1-3-9-22)26-12-14-29-15-13-26/h6-7H,1-5,8-17H2,(H,23,27)(H,24,28)/p+1