(2E)-2-cyano-4,4-dimethyl-hepta-2,6-dienoic acid

Systemtic Name: (2E)-2-cyano-4,4-dimethyl-hepta-2,6-dienoic acid Openeye Name: (2E)-2-cyano-4,4-dimethyl-hepta-2,6-dienoic acid CAS Name: (2E)-2-cyano-4,4-dimethylhepta-2,6-dienoic acid IUPAC Name: (2E)-2-cyano-4,4-dimethylhepta-2,6-dienoic acid Traditional Name: (2E)-2-cyano-4,4-dimethyl-hepta-2,6-dienoic acid Formula: C10H13NO2 MolecularWeight: 179.21572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO2/c1-4-5-10(2,3)6-8(7-11)9(12)13/h4,6H,1,5H2,2-3H3,(H,12,13)/b8-6+