butyl (2E)-5,6-dimethylhepta-2,5-dienoate

Systemtic Name: butyl (2E)-5,6-dimethylhepta-2,5-dienoate Openeye Name: butyl (2E)-5,6-dimethylhepta-2,5-dienoate CAS Name: (2E)-5,6-dimethylhepta-2,5-dienoic acid butyl ester IUPAC Name: butyl (2E)-5,6-dimethylhepta-2,5-dienoate Traditional Name: (2E)-5,6-dimethylhepta-2,5-dienoic acid butyl ester Formula: C13H22O2 MolecularWeight: 210.31258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=CCC(=C(C)C)C

Isomeric SMILES

CCCCOC(=O)/C=C/CC(=C(C)C)C

InChI

InChI=1S/C13H22O2/c1-5-6-10-15-13(14)9-7-8-12(4)11(2)3/h7,9H,5-6,8,10H2,1-4H3/b9-7+