4-cyano-4-[[2-cyano-4-(dioxidanyl)pent-4-en-2-yl]diazenyl]pentanoic acid

Systemtic Name: 4-cyano-4-[[2-cyano-4-(dioxidanyl)pent-4-en-2-yl]diazenyl]pentanoic acid Openeye Name: 4-cyano-4-(1-cyano-3-hydroperoxy-1-methyl-but-3-enyl)azo-pentanoic acid CAS Name: 4-cyano-4-(2-cyano-4-hydroperoxypent-4-en-2-yl)azopentanoic acid IUPAC Name: 4-cyano-4-[(2-cyano-4-hydroperoxypent-4-en-2-yl)diazenyl]pentanoic acid Traditional Name: 4-cyano-4-(1-cyano-3-hydroperoxy-1-methyl-but-3-enyl)azo-valeric acid Formula: C12H16N4O4 MolecularWeight: 280.27984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N4O4/c1-9(20-19)6-12(3,8-14)16-15-11(2,7-13)5-4-10(17)18/h19H,1,4-6H2,2-3H3,(H,17,18)