3,7-dimethyloct-6-en-1-yn-3-yl propanoate

Systemtic Name: 3,7-dimethyloct-6-en-1-yn-3-yl propanoate Openeye Name: (1-ethynyl-1,5-dimethyl-hex-4-enyl) propanoate CAS Name: propanoic acid 3,7-dimethyloct-6-en-1-yn-3-yl ester IUPAC Name: 3,7-dimethyloct-6-en-1-yn-3-yl propanoate Traditional Name: propionic acid (1-ethynyl-1,5-dimethyl-hex-4-enyl) ester Formula: C13H20O2 MolecularWeight: 208.2967

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C)(CCC=C(C)C)C#C

Isomeric SMILES

CCC(=O)OC(C)(CCC=C(C)C)C#C

InChI

InChI=1S/C13H20O2/c1-6-12(14)15-13(5,7-2)10-8-9-11(3)4/h2,9H,6,8,10H2,1,3-5H3