methyl 2-butyl-7-oxidanylidene-octa-2,3-dienoate

Systemtic Name: methyl 2-butyl-7-oxidanylidene-octa-2,3-dienoate Openeye Name: methyl 2-butyl-7-oxo-octa-2,3-dienoate CAS Name: 2-butyl-7-oxoocta-2,3-dienoic acid methyl ester IUPAC Name: methyl 2-butyl-7-oxoocta-2,3-dienoate Traditional Name: 2-butyl-7-keto-octa-2,3-dienoic acid methyl ester Formula: C13H20O3 MolecularWeight: 224.2961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C=CCCC(=O)C)C(=O)OC

Isomeric SMILES

CCCCC(=C=CCCC(=O)C)C(=O)OC

InChI

InChI=1S/C13H20O3/c1-4-5-9-12(13(15)16-3)10-7-6-8-11(2)14/h7H,4-6,8-9H2,1-3H3