3-[2-(2-phenylethanoyl)phenyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-[2-(2-phenylethanoyl)phenyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-[2-(2-phenylacetyl)phenyl]oxadiazol-3-ium-5-olate CAS Name: 3-[2-(1-oxo-2-phenylethyl)phenyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[2-(2-phenylacetyl)phenyl]oxadiazol-3-ium-5-olate Traditional Name: 3-[2-(2-phenylacetyl)phenyl]oxadiazol-3-ium-5-olate Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)C2=CC=CC=C2[N+]3=NOC(=C3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)C2=CC=CC=C2[N+]3=NOC(=C3)[O-]

InChI

InChI=1S/C16H12N2O3/c19-15(10-12-6-2-1-3-7-12)13-8-4-5-9-14(13)18-11-16(20)21-17-18/h1-9,11H,10H2