2-cyano-2-[[2-cyano-1-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]diazenyl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-cyano-2-[[2-cyano-1-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]diazenyl]-5-oxidanylidene-pentanoic acid Openeye Name: 2-(1-carboxy-1-cyano-4-oxo-butyl)azo-2-cyano-5-oxo-pentanoic acid CAS Name: 2-cyano-2-(2-cyano-1-hydroxy-1,5-dioxopentan-2-yl)azo-5-oxopentanoic acid IUPAC Name: 2-cyano-2-[(2-cyano-1-hydroxy-1,5-dioxopentan-2-yl)diazenyl]-5-oxopentanoic acid Traditional Name: 2-(1-carboxy-1-cyano-4-keto-butyl)azo-2-cyano-5-keto-valeric acid Formula: C12H12N4O6 MolecularWeight: 308.24688

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(C#N)(C(=O)O)N=NC(CCC=O)(C#N)C(=O)O)C=O

Isomeric SMILES

C(CC(C#N)(C(=O)O)N=NC(CCC=O)(C#N)C(=O)O)C=O

InChI

InChI=1S/C12H12N4O6/c13-7-11(9(19)20,3-1-5-17)15-16-12(8-14,10(21)22)4-2-6-18/h5-6H,1-4H2,(H,19,20)(H,21,22)