ethyl 4-[2-(2-methoxyphenoxy)ethyl]piperazin-4-ium-1-carboxylate; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 4-[2-(2-methoxyphenoxy)ethyl]piperazin-4-ium-1-carboxylate; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: ethyl 4-[2-(2-methoxyphenoxy)ethyl]piperazin-4-ium-1-carboxylate; 2-hydroxy-2-oxo-acetate CAS Name: 2-hydroxy-2-oxoacetate; 4-[2-(2-methoxyphenoxy)ethyl]-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-methoxyphenoxy)ethyl]piperazin-4-ium-1-carboxylate; 2-hydroxy-2-oxoacetate Traditional Name: 4-[2-(2-methoxyphenoxy)ethyl]piperazin-4-ium-1-carboxylic acid ethyl ester binoxalate Formula: C18H26N2O8 MolecularWeight: 398.40764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH+](CC1)CCOC2=CC=CC=C2OC.C(=O)(C(=O)[O-])O

Isomeric SMILES

CCOC(=O)N1CC[NH+](CC1)CCOC2=CC=CC=C2OC.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C16H24N2O4.C2H2O4/c1-3-21-16(19)18-10-8-17(9-11-18)12-13-22-15-7-5-4-6-14(15)20-2;3-1(4)2(5)6/h4-7H,3,8-13H2,1-2H3;(H,3,4)(H,5,6)