(2E,5E)-6-cyano-4-ethoxycarbonyl-2-methyl-hexa-2,5-dienoic acid

Systemtic Name: (2E,5E)-6-cyano-4-ethoxycarbonyl-2-methyl-hexa-2,5-dienoic acid Openeye Name: (2E,5E)-6-cyano-4-ethoxycarbonyl-2-methyl-hexa-2,5-dienoic acid CAS Name: (2E,5E)-6-cyano-4-ethoxycarbonyl-2-methylhexa-2,5-dienoic acid IUPAC Name: (2E,5E)-6-cyano-4-ethoxycarbonyl-2-methylhexa-2,5-dienoic acid Traditional Name: (2E,5E)-4-carbethoxy-6-cyano-2-methyl-hexa-2,5-dienoic acid Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(/C=C/C#N)/C=C(\C)/C(=O)O

InChI

InChI=1S/C11H13NO4/c1-3-16-11(15)9(5-4-6-12)7-8(2)10(13)14/h4-5,7,9H,3H2,1-2H3,(H,13,14)/b5-4+,8-7+