5-[[(2Z)-2-(nitromethylidene)-1,3-diazinan-1-yl]methyl]pyridine-2-carbonitrile

Systemtic Name: 5-[[(2Z)-2-(nitromethylidene)-1,3-diazinan-1-yl]methyl]pyridine-2-carbonitrile Openeye Name: 5-[[(2Z)-2-(nitromethylene)hexahydropyrimidin-1-yl]methyl]pyridine-2-carbonitrile CAS Name: 5-[[(2Z)-2-(nitromethylidene)-1,3-diazinan-1-yl]methyl]-2-pyridinecarbonitrile IUPAC Name: 5-[[(2Z)-2-(nitromethylidene)-1,3-diazinan-1-yl]methyl]pyridine-2-carbonitrile Traditional Name: 5-[[(2Z)-2-(nitromethylene)hexahydropyrimidin-1-yl]methyl]picolinonitrile Formula: C12H13N5O2 MolecularWeight: 259.26392

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=C[N+](=O)[O-])N(C1)CC2=CN=C(C=C2)C#N

Isomeric SMILES

C1CN/C(=C/[N+](=O)[O-])/N(C1)CC2=CN=C(C=C2)C#N

InChI

InChI=1S/C12H13N5O2/c13-6-11-3-2-10(7-15-11)8-16-5-1-4-14-12(16)9-17(18)19/h2-3,7,9,14H,1,4-5,8H2/b12-9-