2-(5-oxidanylidene-3-propan-2-yl-2H-1,2,3-oxadiazol-3-ium-4-yl)ethanoate

Systemtic Name: 2-(5-oxidanylidene-3-propan-2-yl-2H-1,2,3-oxadiazol-3-ium-4-yl)ethanoate Openeye Name: 2-(3-isopropyl-5-oxo-2H-oxadiazol-3-ium-4-yl)acetate CAS Name: 2-(5-oxo-3-propan-2-yl-2H-oxadiazol-3-ium-4-yl)acetate IUPAC Name: 2-(5-oxo-3-propan-2-yl-2H-oxadiazol-3-ium-4-yl)acetate Traditional Name: 2-(3-isopropyl-5-keto-2H-oxadiazol-3-ium-4-yl)acetate Formula: C7H10N2O4 MolecularWeight: 186.1653

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=C(C(=O)ON1)CC(=O)[O-]

Isomeric SMILES

CC(C)[N+]1=C(C(=O)ON1)CC(=O)[O-]

InChI

InChI=1S/C7H10N2O4/c1-4(2)9-5(3-6(10)11)7(12)13-8-9/h4H,3H2,1-2H3,(H-,8,10,11,12)