3-pentyl-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 3-pentyl-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 3-pentyl-2H-oxadiazol-3-ium-5-one CAS Name: 3-pentyl-2H-oxadiazol-3-ium-5-one IUPAC Name: 3-pentyl-2H-oxadiazol-3-ium-5-one Traditional Name: 3-amyl-2H-oxadiazol-3-ium-5-one Formula: C7H13N2O2+ MolecularWeight: 157.19032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1=CC(=O)ON1

Isomeric SMILES

CCCCC[N+]1=CC(=O)ON1

InChI

InChI=1S/C7H12N2O2/c1-2-3-4-5-9-6-7(10)11-8-9/h6H,2-5H2,1H3/p+1