2-methyl-2-propa-1,2-dienyl-octanoate

Systemtic Name: 2-methyl-2-propa-1,2-dienyl-octanoate Openeye Name: 2-methyl-2-propa-1,2-dienyl-octanoate CAS Name: 2-methyl-2-propa-1,2-dienyloctanoate IUPAC Name: 2-methyl-2-propa-1,2-dienyloctanoate Traditional Name: 2-hexyl-2-methyl-penta-3,4-dienoate Formula: C12H19O2- MolecularWeight: 195.27806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C=C=C)C(=O)[O-]

Isomeric SMILES

CCCCCCC(C)(C=C=C)C(=O)[O-]

InChI

InChI=1S/C12H20O2/c1-4-6-7-8-10-12(3,9-5-2)11(13)14/h9H,2,4,6-8,10H2,1,3H3,(H,13,14)/p-1