3-cyano-3-[(2-cyano-4-oxidanyl-4-oxidanylidene-butan-2-yl)diazenyl]butanoic acid

Systemtic Name: 3-cyano-3-[(2-cyano-4-oxidanyl-4-oxidanylidene-butan-2-yl)diazenyl]butanoic acid Openeye Name: 3-cyano-3-(1-cyano-3-hydroxy-1-methyl-3-oxo-propyl)azo-butanoic acid CAS Name: 3-cyano-3-(2-cyano-4-hydroxy-4-oxobutan-2-yl)azobutanoic acid IUPAC Name: 3-cyano-3-[(2-cyano-4-hydroxy-4-oxobutan-2-yl)diazenyl]butanoic acid Traditional Name: 3-cyano-3-(1-cyano-3-hydroxy-3-keto-1-methyl-propyl)azo-butyric acid Formula: C10H12N4O4 MolecularWeight: 252.22668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N4O4/c1-9(5-11,3-7(15)16)13-14-10(2,6-12)4-8(17)18/h3-4H2,1-2H3,(H,15,16)(H,17,18)