5-[3,5-bis(trifluoromethyl)phenyl]-2H-1,2,3,4-tetrazole

Systemtic Name: 5-[3,5-bis(trifluoromethyl)phenyl]-2H-1,2,3,4-tetrazole Openeye Name: 5-[3,5-bis(trifluoromethyl)phenyl]-2H-tetrazole CAS Name: 5-[3,5-bis(trifluoromethyl)phenyl]-2H-tetrazole IUPAC Name: 5-[3,5-bis(trifluoromethyl)phenyl]-2H-tetrazole Traditional Name: 5-[3,5-bis(trifluoromethyl)phenyl]-2H-tetrazole Formula: C9H4F6N4 MolecularWeight: 282.145279

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=NNN=N2

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=NNN=N2

InChI

InChI=1S/C9H4F6N4/c10-8(11,12)5-1-4(7-16-18-19-17-7)2-6(3-5)9(13,14)15/h1-3H,(H,16,17,18,19)