3-phenyl-4-(2-phenylethynyl)-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 3-phenyl-4-(2-phenylethynyl)-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 3-phenyl-4-(2-phenylethynyl)-2H-oxadiazol-3-ium-5-one CAS Name: 3-phenyl-4-(2-phenylethynyl)-2H-oxadiazol-3-ium-5-one IUPAC Name: 3-phenyl-4-(2-phenylethynyl)-2H-oxadiazol-3-ium-5-one Traditional Name: 3-phenyl-4-(2-phenylethynyl)-2H-oxadiazol-3-ium-5-one Formula: C16H11N2O2+ MolecularWeight: 263.27074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=[N+](NOC2=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=[N+](NOC2=O)C3=CC=CC=C3

InChI

InChI=1S/C16H10N2O2/c19-16-15(12-11-13-7-3-1-4-8-13)18(17-20-16)14-9-5-2-6-10-14/h1-10H/p+1