3-butyl-5-oxidanylidene-2H-1,2,3-oxadiazol-3-ium-4-carboxylic acid

Systemtic Name: 3-butyl-5-oxidanylidene-2H-1,2,3-oxadiazol-3-ium-4-carboxylic acid Openeye Name: 3-butyl-5-oxo-2H-oxadiazol-3-ium-4-carboxylic acid CAS Name: 3-butyl-5-oxo-2H-oxadiazol-3-ium-4-carboxylic acid IUPAC Name: 3-butyl-5-oxo-2H-oxadiazol-3-ium-4-carboxylic acid Traditional Name: 3-butyl-5-keto-2H-oxadiazol-3-ium-4-carboxylic acid Formula: C7H11N2O4+ MolecularWeight: 187.17324

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C(C(=O)ON1)C(=O)O

Isomeric SMILES

CCCC[N+]1=C(C(=O)ON1)C(=O)O

InChI

InChI=1S/C7H10N2O4/c1-2-3-4-9-5(6(10)11)7(12)13-8-9/h2-4H2,1H3,(H-,8,10,11,12)/p+1