diethyl 2-ethynyl-2-(phenylmethyl)propanedioate

Systemtic Name: diethyl 2-ethynyl-2-(phenylmethyl)propanedioate Openeye Name: diethyl 2-benzyl-2-ethynyl-propanedioate CAS Name: 2-ethynyl-2-(phenylmethyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-benzyl-2-ethynylpropanedioate Traditional Name: 2-benzyl-2-ethynyl-malonic acid diethyl ester Formula: C16H18O4 MolecularWeight: 274.31172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)(C#C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)(C#C)C(=O)OCC

InChI

InChI=1S/C16H18O4/c1-4-16(14(17)19-5-2,15(18)20-6-3)12-13-10-8-7-9-11-13/h1,7-11H,5-6,12H2,2-3H3