diazanium 4-cyano-4-[(2-cyano-5-oxidanidyl-5-oxidanylidene-pentan-2-yl)diazenyl]pentanoate

Systemtic Name: diazanium 4-cyano-4-[(2-cyano-5-oxidanidyl-5-oxidanylidene-pentan-2-yl)diazenyl]pentanoate Openeye Name: diammonium 4-cyano-4-(1-cyano-1-methyl-4-oxido-4-oxo-butyl)azo-pentanoate CAS Name: diammonium 4-cyano-4-(2-cyano-5-oxido-5-oxopentan-2-yl)azopentanoate IUPAC Name: diazanium 4-cyano-4-[(2-cyano-5-oxido-5-oxopentan-2-yl)diazenyl]pentanoate Traditional Name: diammonium 4-cyano-4-(1-cyano-4-keto-1-methyl-4-oxido-butyl)azo-valerate Formula: C12H22N6O4 MolecularWeight: 314.34088

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)[O-])(C#N)N=NC(C)(CCC(=O)[O-])C#N.[NH4+].[NH4+]

Isomeric SMILES

CC(CCC(=O)[O-])(C#N)N=NC(C)(CCC(=O)[O-])C#N.[NH4+].[NH4+]

InChI

InChI=1S/C12H16N4O4.2H3N/c1-11(7-13,5-3-9(17)18)15-16-12(2,8-14)6-4-10(19)20;;/h3-6H2,1-2H3,(H,17,18)(H,19,20);2*1H3