3-[2-[2-(4-aminophenyl)ethynyl]phenyl]-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 3-[2-[2-(4-aminophenyl)ethynyl]phenyl]-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 3-[2-[2-(4-aminophenyl)ethynyl]phenyl]-2H-oxadiazol-3-ium-5-one CAS Name: 3-[2-[2-(4-aminophenyl)ethynyl]phenyl]-2H-oxadiazol-3-ium-5-one IUPAC Name: 3-[2-[2-(4-aminophenyl)ethynyl]phenyl]-2H-oxadiazol-3-ium-5-one Traditional Name: 3-[2-[2-(4-aminophenyl)ethynyl]phenyl]-2H-oxadiazol-3-ium-5-one Formula: C16H12N3O2+ MolecularWeight: 278.28538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#CC2=CC=C(C=C2)N)[N+]3=CC(=O)ON3

Isomeric SMILES

C1=CC=C(C(=C1)C#CC2=CC=C(C=C2)N)[N+]3=CC(=O)ON3

InChI

InChI=1S/C16H11N3O2/c17-14-9-6-12(7-10-14)5-8-13-3-1-2-4-15(13)19-11-16(20)21-18-19/h1-4,6-7,9-11H,(H2-,17,18,20)/p+1