(2Z)-2-(cyanomethylidene)-4-oxidanyl-3-oxidanylidene-octanoate

Systemtic Name: (2Z)-2-(cyanomethylidene)-4-oxidanyl-3-oxidanylidene-octanoate Openeye Name: (2Z)-2-(cyanomethylene)-4-hydroxy-3-oxo-octanoate CAS Name: (2Z)-2-(cyanomethylidene)-4-hydroxy-3-oxooctanoate IUPAC Name: (2Z)-2-(cyanomethylidene)-4-hydroxy-3-oxooctanoate Traditional Name: (Z)-3-cyano-2-(2-hydroxyhexanoyl)acrylate Formula: C10H12NO4- MolecularWeight: 210.20658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(=CC#N)C(=O)[O-])O

Isomeric SMILES

CCCCC(C(=O)/C(=C/C#N)/C(=O)[O-])O

InChI

InChI=1S/C10H13NO4/c1-2-3-4-8(12)9(13)7(5-6-11)10(14)15/h5,8,12H,2-4H2,1H3,(H,14,15)/p-1/b7-5-