diethyl 2-methyl-2-(3-phenylprop-2-ynyl)propanedioate

Systemtic Name: diethyl 2-methyl-2-(3-phenylprop-2-ynyl)propanedioate Openeye Name: diethyl 2-methyl-2-(3-phenylprop-2-ynyl)propanedioate CAS Name: 2-methyl-2-(3-phenylprop-2-ynyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-methyl-2-(3-phenylprop-2-ynyl)propanedioate Traditional Name: 2-methyl-2-(3-phenylprop-2-ynyl)malonic acid diethyl ester Formula: C17H20O4 MolecularWeight: 288.3383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20O4/c1-4-20-15(18)17(3,16(19)21-5-2)13-9-12-14-10-7-6-8-11-14/h6-8,10-11H,4-5,13H2,1-3H3