2-oxidanyl-2-oxidanylidene-ethanoate; 1-[2-(4-phenylpiperazin-4-ium-1-yl)ethanoyl]piperidine-4-carboxamide

Systemtic Name: 2-oxidanyl-2-oxidanylidene-ethanoate; 1-[2-(4-phenylpiperazin-4-ium-1-yl)ethanoyl]piperidine-4-carboxamide Openeye Name: 2-hydroxy-2-oxo-acetate; 1-[2-(4-phenylpiperazin-4-ium-1-yl)acetyl]piperidine-4-carboxamide CAS Name: 2-hydroxy-2-oxoacetate; 1-[1-oxo-2-(4-phenyl-1-piperazin-4-iumyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 2-hydroxy-2-oxoacetate; 1-[2-(4-phenylpiperazin-4-ium-1-yl)acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-(4-phenylpiperazin-4-ium-1-yl)acetyl]isonipecotamide binoxalate Formula: C20H28N4O6 MolecularWeight: 420.45952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)CN2CC[NH+](CC2)C3=CC=CC=C3.C(=O)(C(=O)[O-])O

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)CN2CC[NH+](CC2)C3=CC=CC=C3.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C18H26N4O2.C2H2O4/c19-18(24)15-6-8-22(9-7-15)17(23)14-20-10-12-21(13-11-20)16-4-2-1-3-5-16;3-1(4)2(5)6/h1-5,15H,6-14H2,(H2,19,24);(H,3,4)(H,5,6)