2-[(2Z,4E)-7-methylocta-2,4,6-trien-2-yl]propanedioic acid

Systemtic Name: 2-[(2Z,4E)-7-methylocta-2,4,6-trien-2-yl]propanedioic acid Openeye Name: 2-[(1Z,3E)-1,6-dimethylhepta-1,3,5-trienyl]propanedioic acid CAS Name: 2-[(2Z,4E)-7-methylocta-2,4,6-trien-2-yl]propanedioic acid IUPAC Name: 2-[(2Z,4E)-7-methylocta-2,4,6-trien-2-yl]propanedioic acid Traditional Name: 2-[(1Z,3E)-1,6-dimethylhepta-1,3,5-trienyl]malonic acid Formula: C12H16O4 MolecularWeight: 224.25304

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=CC=C(C)C(C(=O)O)C(=O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C12H16O4/c1-8(2)6-4-5-7-9(3)10(11(13)14)12(15)16/h4-7,10H,1-3H3,(H,13,14)(H,15,16)/b5-4+,9-7-