2-(3H-benzimidazol-1-ium-1-ylmethoxy)ethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2-(3H-benzimidazol-1-ium-1-ylmethoxy)ethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-(3H-benzimidazol-1-ium-1-ylmethoxy)ethyl-dimethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 2-(3H-benzimidazol-1-ium-1-ylmethoxy)ethyl-dimethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 2-(3H-benzimidazol-1-ium-1-ylmethoxy)ethyl-dimethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 2-(3H-benzimidazol-1-ium-1-ylmethoxy)ethyl-dimethyl-ammonium dibinoxalate Formula: C16H21N3O9 MolecularWeight: 399.35264

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC[N+]1=CNC2=CC=CC=C21.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

Isomeric SMILES

C[NH+](C)CCOC[N+]1=CNC2=CC=CC=C21.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C12H17N3O.2C2H2O4/c1-14(2)7-8-16-10-15-9-13-11-5-3-4-6-12(11)15;2*3-1(4)2(5)6/h3-6,9H,7-8,10H2,1-2H3;2*(H,3,4)(H,5,6)