diethyl 2-but-2-ynyl-2-[(E)-pent-3-en-2-yl]propanedioate

Systemtic Name: diethyl 2-but-2-ynyl-2-[(E)-pent-3-en-2-yl]propanedioate Openeye Name: diethyl 2-but-2-ynyl-2-[(E)-1-methylbut-2-enyl]propanedioate CAS Name: 2-but-2-ynyl-2-[(E)-pent-3-en-2-yl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-but-2-ynyl-2-[(E)-pent-3-en-2-yl]propanedioate Traditional Name: 2-but-2-ynyl-2-[(E)-1-methylbut-2-enyl]malonic acid diethyl ester Formula: C16H24O4 MolecularWeight: 280.35936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(CC#CC)(C(C)/C=C/C)C(=O)OCC

InChI

InChI=1S/C16H24O4/c1-6-10-12-16(13(5)11-7-2,14(17)19-8-3)15(18)20-9-4/h7,11,13H,8-9,12H2,1-5H3/b11-7+