1-[(2-chlorophenyl)methyl]-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-6-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 1-[(2-chlorophenyl)methyl]-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-6-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-[(2-chlorophenyl)methyl]-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-6-oxo-pyridine-3-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-6-oxo-3-pyridinecarboxamide IUPAC Name: 1-[(2-chlorophenyl)methyl]-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-6-oxopyridine-3-carboxamide Traditional Name: 1-(2-chlorobenzyl)-6-keto-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]nicotinamide Formula: C23H24ClN4O3+ MolecularWeight: 439.91466

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=CN(C(=O)C=C3)CC4=CC=CC=C4Cl

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=CN(C(=O)C=C3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C23H23ClN4O3/c24-20-4-2-1-3-18(20)15-28-16-19(6-8-22(28)29)23(30)26-14-17-5-7-21(25-13-17)27-9-11-31-12-10-27/h1-8,13,16H,9-12,14-15H2,(H,26,30)/p+1