O1-ethyl O3-ethynyl 2-(4-ethanoylpiperazin-1-yl)propanedioate

Systemtic Name: O1-ethyl O3-ethynyl 2-(4-ethanoylpiperazin-1-yl)propanedioate Openeye Name: O1-ethyl O3-ethynyl 2-(4-acetylpiperazin-1-yl)propanedioate CAS Name: 2-(4-acetyl-1-piperazinyl)propanedioic acid O1-ethyl ester O3-ethynyl ester IUPAC Name: 1-O-ethyl 3-O-ethynyl 2-(4-acetylpiperazin-1-yl)propanedioate Traditional Name: 2-(4-acetylpiperazino)malonic acid O1-ethyl ester O3-ethynyl ester Formula: C13H18N2O5 MolecularWeight: 282.29242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OC#C)N1CCN(CC1)C(=O)C

Isomeric SMILES

CCOC(=O)C(C(=O)OC#C)N1CCN(CC1)C(=O)C

InChI

InChI=1S/C13H18N2O5/c1-4-19-12(17)11(13(18)20-5-2)15-8-6-14(7-9-15)10(3)16/h1,11H,5-9H2,2-3H3