3-(4-butoxyphenyl)-4-ethanoyl-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-(4-butoxyphenyl)-4-ethanoyl-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 4-acetyl-3-(4-butoxyphenyl)oxadiazol-3-ium-5-olate CAS Name: 4-acetyl-3-(4-butoxyphenyl)-5-oxadiazol-3-iumolate IUPAC Name: 4-acetyl-3-(4-butoxyphenyl)oxadiazol-3-ium-5-olate Traditional Name: 4-acetyl-3-(4-butoxyphenyl)oxadiazol-3-ium-5-olate Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)[N+]2=NOC(=C2C(=O)C)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)[N+]2=NOC(=C2C(=O)C)[O-]

InChI

InChI=1S/C14H16N2O4/c1-3-4-9-19-12-7-5-11(6-8-12)16-13(10(2)17)14(18)20-15-16/h5-8H,3-4,9H2,1-2H3