6-methyl-2-morpholin-4-yl-5-(1-oxidanidylpyridin-1-ium-4-yl)pyridine-3-carbonitrile

Systemtic Name: 6-methyl-2-morpholin-4-yl-5-(1-oxidanidylpyridin-1-ium-4-yl)pyridine-3-carbonitrile Openeye Name: 6-methyl-2-morpholino-5-(1-oxidopyridin-1-ium-4-yl)pyridine-3-carbonitrile CAS Name: 6-methyl-2-(4-morpholinyl)-5-(1-oxido-4-pyridin-1-iumyl)-3-pyridinecarbonitrile IUPAC Name: 6-methyl-2-morpholin-4-yl-5-(1-oxidopyridin-1-ium-4-yl)pyridine-3-carbonitrile Traditional Name: 6-methyl-2-morpholino-5-(1-oxidopyridin-1-ium-4-yl)nicotinonitrile Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)N2CCOCC2)C#N)C3=CC=[N+](C=C3)[O-]

Isomeric SMILES

CC1=C(C=C(C(=N1)N2CCOCC2)C#N)C3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C16H16N4O2/c1-12-15(13-2-4-20(21)5-3-13)10-14(11-17)16(18-12)19-6-8-22-9-7-19/h2-5,10H,6-9H2,1H3