4-butanoyl-3-phenyl-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 4-butanoyl-3-phenyl-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 4-butanoyl-3-phenyl-2H-oxadiazol-3-ium-5-one CAS Name: 4-(1-oxobutyl)-3-phenyl-2H-oxadiazol-3-ium-5-one IUPAC Name: 4-butanoyl-3-phenyl-2H-oxadiazol-3-ium-5-one Traditional Name: 4-butyryl-3-phenyl-2H-oxadiazol-3-ium-5-one Formula: C12H13N2O3+ MolecularWeight: 233.24322

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=[N+](NOC1=O)C2=CC=CC=C2

Isomeric SMILES

CCCC(=O)C1=[N+](NOC1=O)C2=CC=CC=C2

InChI

InChI=1S/C12H12N2O3/c1-2-6-10(15)11-12(16)17-13-14(11)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3/p+1