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

Systemtic Name: 4-ethanoyl-3-(4-propoxyphenyl)-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 4-acetyl-3-(4-propoxyphenyl)oxadiazol-3-ium-5-olate CAS Name: 4-acetyl-3-(4-propoxyphenyl)-5-oxadiazol-3-iumolate IUPAC Name: 4-acetyl-3-(4-propoxyphenyl)oxadiazol-3-ium-5-olate Traditional Name: 4-acetyl-3-(4-propoxyphenyl)oxadiazol-3-ium-5-olate Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)[N+]2=NOC(=C2C(=O)C)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)[N+]2=NOC(=C2C(=O)C)[O-]

InChI

InChI=1S/C13H14N2O4/c1-3-8-18-11-6-4-10(5-7-11)15-12(9(2)16)13(17)19-14-15/h4-7H,3,8H2,1-2H3