diethyl 2-(4-pyrrolidin-1-ium-1-ylbut-2-ynyl)propanedioate

Systemtic Name: diethyl 2-(4-pyrrolidin-1-ium-1-ylbut-2-ynyl)propanedioate Openeye Name: diethyl 2-(4-pyrrolidin-1-ium-1-ylbut-2-ynyl)propanedioate CAS Name: 2-[4-(1-pyrrolidin-1-iumyl)but-2-ynyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(4-pyrrolidin-1-ium-1-ylbut-2-ynyl)propanedioate Traditional Name: 2-(4-pyrrolidin-1-ium-1-ylbut-2-ynyl)malonic acid diethyl ester Formula: C15H24NO4+ MolecularWeight: 282.35536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC#CC[NH+]1CCCC1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC#CC[NH+]1CCCC1)C(=O)OCC

InChI

InChI=1S/C15H23NO4/c1-3-19-14(17)13(15(18)20-4-2)9-5-6-10-16-11-7-8-12-16/h13H,3-4,7-12H2,1-2H3/p+1