methyl-(2-pyridin-2-ylethyl)-[(2,3,4-trimethoxyphenyl)methyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: methyl-(2-pyridin-2-ylethyl)-[(2,3,4-trimethoxyphenyl)methyl]azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-hydroxy-2-oxo-acetate; methyl-[2-(2-pyridyl)ethyl]-[(2,3,4-trimethoxyphenyl)methyl]ammonium CAS Name: 2-hydroxy-2-oxoacetate; methyl-[2-(2-pyridinyl)ethyl]-[(2,3,4-trimethoxyphenyl)methyl]ammonium IUPAC Name: 2-hydroxy-2-oxoacetate; methyl-(2-pyridin-2-ylethyl)-[(2,3,4-trimethoxyphenyl)methyl]azanium Traditional Name: methyl-[2-(2-pyridyl)ethyl]-(2,3,4-trimethoxybenzyl)ammonium binoxalate Formula: C20H26N2O7 MolecularWeight: 406.42964

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=N1)CC2=C(C(=C(C=C2)OC)OC)OC.C(=O)(C(=O)[O-])O

Isomeric SMILES

C[NH+](CCC1=CC=CC=N1)CC2=C(C(=C(C=C2)OC)OC)OC.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C18H24N2O3.C2H2O4/c1-20(12-10-15-7-5-6-11-19-15)13-14-8-9-16(21-2)18(23-4)17(14)22-3;3-1(4)2(5)6/h5-9,11H,10,12-13H2,1-4H3;(H,3,4)(H,5,6)