diethyl 2-acetamido-2-[2-(4-methylphenyl)ethynyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[2-(4-methylphenyl)ethynyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[2-(p-tolyl)ethynyl]propanedioate CAS Name: 2-acetamido-2-[2-(4-methylphenyl)ethynyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[2-(4-methylphenyl)ethynyl]propanedioate Traditional Name: 2-acetamido-2-[2-(p-tolyl)ethynyl]malonic acid diethyl ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO5/c1-5-23-16(21)18(19-14(4)20,17(22)24-6-2)12-11-15-9-7-13(3)8-10-15/h7-10H,5-6H2,1-4H3,(H,19,20)