diethyl 2-[(E)-but-2-enyl]-2-prop-2-ynyl-propanedioate

Systemtic Name: diethyl 2-[(E)-but-2-enyl]-2-prop-2-ynyl-propanedioate Openeye Name: diethyl 2-[(E)-but-2-enyl]-2-prop-2-ynyl-propanedioate CAS Name: 2-[(E)-but-2-enyl]-2-prop-2-ynylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[(E)-but-2-enyl]-2-prop-2-ynylpropanedioate Traditional Name: 2-[(E)-but-2-enyl]-2-propargyl-malonic acid diethyl ester Formula: C14H20O4 MolecularWeight: 252.3062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O4/c1-5-9-11-14(10-6-2,12(15)17-7-3)13(16)18-8-4/h2,5,9H,7-8,10-11H2,1,3-4H3/b9-5+