(2E)-2-cyano-N-heptyl-2-[(4-nitro-1H-imidazol-5-yl)hydrazinylidene]ethanamide

Systemtic Name: (2E)-2-cyano-N-heptyl-2-[(4-nitro-1H-imidazol-5-yl)hydrazinylidene]ethanamide Openeye Name: (1E)-2-(heptylamino)-N-[(4-nitro-1H-imidazol-5-yl)amino]-2-oxo-acetimidoyl cyanide CAS Name: (2E)-2-cyano-N-heptyl-2-[(4-nitro-1H-imidazol-5-yl)hydrazinylidene]acetamide IUPAC Name: (1E)-2-(heptylamino)-N-[(4-nitro-1H-imidazol-5-yl)amino]-2-oxoethanimidoyl cyanide Traditional Name: (2E)-2-cyano-N-heptyl-2-[(4-nitro-1H-imidazol-5-yl)hydrazono]acetamide Formula: C13H19N7O3 MolecularWeight: 321.33506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)C(=NNC1=C(N=CN1)[N+](=O)[O-])C#N

Isomeric SMILES

CCCCCCCNC(=O)/C(=N/NC1=C(N=CN1)[N+](=O)[O-])/C#N

InChI

InChI=1S/C13H19N7O3/c1-2-3-4-5-6-7-15-13(21)10(8-14)18-19-11-12(20(22)23)17-9-16-11/h9,19H,2-7H2,1H3,(H,15,21)(H,16,17)/b18-10+