(E)-4-cyano-4-[[(E)-2-cyano-5-oxidanyl-5-oxidanylidene-pent-3-en-2-yl]diazenyl]pent-2-enoic acid

Systemtic Name: (E)-4-cyano-4-[[(E)-2-cyano-5-oxidanyl-5-oxidanylidene-pent-3-en-2-yl]diazenyl]pent-2-enoic acid Openeye Name: (E)-4-cyano-4-[(E)-1-cyano-4-hydroxy-1-methyl-4-oxo-but-2-enyl]azo-pent-2-enoic acid CAS Name: (E)-4-cyano-4-[(E)-2-cyano-5-hydroxy-5-oxopent-3-en-2-yl]azo-2-pentenoic acid IUPAC Name: (E)-4-cyano-4-[[(E)-2-cyano-5-hydroxy-5-oxopent-3-en-2-yl]diazenyl]pent-2-enoic acid Traditional Name: (E)-4-cyano-4-[(E)-1-cyano-4-hydroxy-4-keto-1-methyl-but-2-enyl]azo-pent-2-enoic acid Formula: C12H12N4O4 MolecularWeight: 276.24808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N4O4/c1-11(7-13,5-3-9(17)18)15-16-12(2,8-14)6-4-10(19)20/h3-6H,1-2H3,(H,17,18)(H,19,20)/b5-3+,6-4+,16-15?