disodium 2-[2-[1-(2-oxidanidyl-2-oxidanylidene-ethyl)pyrazol-1-ium-1-yl]ethylamino]ethanoate

Systemtic Name: disodium 2-[2-[1-(2-oxidanidyl-2-oxidanylidene-ethyl)pyrazol-1-ium-1-yl]ethylamino]ethanoate Openeye Name: disodium 2-[2-[1-(2-oxido-2-oxo-ethyl)pyrazol-1-ium-1-yl]ethylamino]acetate CAS Name: disodium 2-[2-[1-(2-oxido-2-oxoethyl)-1-pyrazol-1-iumyl]ethylamino]acetate IUPAC Name: disodium 2-[2-[1-(2-oxido-2-oxoethyl)pyrazol-1-ium-1-yl]ethylamino]acetate Traditional Name: disodium 2-[2-[1-(2-keto-2-oxido-ethyl)pyrazol-1-ium-1-yl]ethylamino]acetate Formula: C9H12N3Na2O4+ MolecularWeight: 272.18882

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](N=C1)(CCNCC(=O)[O-])CC(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=C[N+](N=C1)(CCNCC(=O)[O-])CC(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C9H13N3O4.2Na/c13-8(14)6-10-3-5-12(7-9(15)16)4-1-2-11-12;;/h1-2,4,10H,3,5-7H2,(H-,13,14,15,16);;/q;2*+1/p-1