2-[(2-azanyl-5-nitro-4-oxidanylidene-1H-pyrimidin-6-yl)amino]ethanenitrile

Systemtic Name: 2-[(2-azanyl-5-nitro-4-oxidanylidene-1H-pyrimidin-6-yl)amino]ethanenitrile Openeye Name: 2-[(2-amino-5-nitro-4-oxo-1H-pyrimidin-6-yl)amino]acetonitrile CAS Name: 2-[(2-amino-5-nitro-4-oxo-1H-pyrimidin-6-yl)amino]acetonitrile IUPAC Name: 2-[(2-amino-5-nitro-4-oxo-1H-pyrimidin-6-yl)amino]acetonitrile Traditional Name: 2-[(2-amino-4-keto-5-nitro-1H-pyrimidin-6-yl)amino]acetonitrile Formula: C6H6N6O3 MolecularWeight: 210.15024

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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)NC1=C(C(=O)N=C(N1)N)[N+](=O)[O-]

Isomeric SMILES

C(C#N)NC1=C(C(=O)N=C(N1)N)[N+](=O)[O-]

InChI

InChI=1S/C6H6N6O3/c7-1-2-9-4-3(12(14)15)5(13)11-6(8)10-4/h2H2,(H4,8,9,10,11,13)