diethyl 2-oct-3-yn-2-ylpropanedioate

Systemtic Name: diethyl 2-oct-3-yn-2-ylpropanedioate Openeye Name: diethyl 2-(1-methylhept-2-ynyl)propanedioate CAS Name: 2-oct-3-yn-2-ylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-oct-3-yn-2-ylpropanedioate Traditional Name: 2-(1-methylhept-2-ynyl)malonic acid diethyl ester Formula: C15H24O4 MolecularWeight: 268.34866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(C)C(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCCC#CC(C)C(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C15H24O4/c1-5-8-9-10-11-12(4)13(14(16)18-6-2)15(17)19-7-3/h12-13H,5-9H2,1-4H3