5-[4-[2-(5-nitrofuran-2-yl)ethynyl]phenyl]-2H-1,2,3,4-tetrazole

Systemtic Name: 5-[4-[2-(5-nitrofuran-2-yl)ethynyl]phenyl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[4-[2-(5-nitro-2-furyl)ethynyl]phenyl]-2H-tetrazole CAS Name: 5-[4-[2-(5-nitro-2-furanyl)ethynyl]phenyl]-2H-tetrazole IUPAC Name: 5-[4-[2-(5-nitrofuran-2-yl)ethynyl]phenyl]-2H-tetrazole Traditional Name: 5-[4-[2-(5-nitro-2-furyl)ethynyl]phenyl]-2H-tetrazole Formula: C13H7N5O3 MolecularWeight: 281.22638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC2=CC=C(O2)[N+](=O)[O-])C3=NNN=N3

Isomeric SMILES

C1=CC(=CC=C1C#CC2=CC=C(O2)[N+](=O)[O-])C3=NNN=N3

InChI

InChI=1S/C13H7N5O3/c19-18(20)12-8-7-11(21-12)6-3-9-1-4-10(5-2-9)13-14-16-17-15-13/h1-2,4-5,7-8H,(H,14,15,16,17)