2-[(2E)-3,7-dimethylocta-2,6-dienyl]propanedioic acid

Systemtic Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]propanedioic acid Openeye Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]propanedioic acid CAS Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]propanedioic acid IUPAC Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]propanedioic acid Traditional Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]malonic acid Formula: C13H20O4 MolecularWeight: 240.2955

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCC(C(=O)O)C(=O)O)C)C

Isomeric SMILES

CC(=CCC/C(=C/CC(C(=O)O)C(=O)O)/C)C

InChI

InChI=1S/C13H20O4/c1-9(2)5-4-6-10(3)7-8-11(12(14)15)13(16)17/h5,7,11H,4,6,8H2,1-3H3,(H,14,15)(H,16,17)/b10-7+