3-(1H-imidazol-5-yl)propoxycarbonyl-prop-2-ynyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 3-(1H-imidazol-5-yl)propoxycarbonyl-prop-2-ynyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-hydroxy-2-oxo-acetate; 3-(1H-imidazol-5-yl)propoxycarbonyl-prop-2-ynyl-ammonium CAS Name: 2-hydroxy-2-oxoacetate; [3-(1H-imidazol-5-yl)propoxy-oxomethyl]-prop-2-ynylammonium IUPAC Name: 2-hydroxy-2-oxoacetate; 3-(1H-imidazol-5-yl)propoxycarbonyl-prop-2-ynylazanium Traditional Name: 3-(1H-imidazol-5-yl)propoxycarbonyl-propargyl-ammonium binoxalate Formula: C12H15N3O6 MolecularWeight: 297.264

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Descriptors Computed from Structure

Canonical SMILES:

C#CC[NH2+]C(=O)OCCCC1=CN=CN1.C(=O)(C(=O)[O-])O

Isomeric SMILES

C#CC[NH2+]C(=O)OCCCC1=CN=CN1.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C10H13N3O2.C2H2O4/c1-2-5-12-10(14)15-6-3-4-9-7-11-8-13-9;3-1(4)2(5)6/h1,7-8H,3-6H2,(H,11,13)(H,12,14);(H,3,4)(H,5,6)