2-[butylamino(iminomethyl)amino]ethyl nitrate; pyridine-3-carbonitrile

Systemtic Name: 2-[butylamino(iminomethyl)amino]ethyl nitrate; pyridine-3-carbonitrile Openeye Name: 2-[butylamino(methanimidoyl)amino]ethyl nitrate; pyridine-3-carbonitrile CAS Name: nitric acid 2-[butylamino(methanimidoyl)amino]ethyl ester; 3-pyridinecarbonitrile IUPAC Name: 2-[butylamino(methanimidoyl)amino]ethyl nitrate; pyridine-3-carbonitrile Traditional Name: nicotinonitrile; nitric acid 2-[butylamino(formimidoyl)amino]ethyl ester Formula: C13H20N6O3 MolecularWeight: 308.3363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNN(CCO[N+](=O)[O-])C=N.C1=CC(=CN=C1)C#N

Isomeric SMILES

CCCCNN(CCO[N+](=O)[O-])C=N.C1=CC(=CN=C1)C#N

InChI

InChI=1S/C7H16N4O3.C6H4N2/c1-2-3-4-9-10(7-8)5-6-14-11(12)13;7-4-6-2-1-3-8-5-6/h7-9H,2-6H2,1H3;1-3,5H