3-(3-iodanylphenyl)-5-(trifluoromethyl)-1H-1,2,4-triazole

Systemtic Name: 3-(3-iodanylphenyl)-5-(trifluoromethyl)-1H-1,2,4-triazole Openeye Name: 3-(3-iodophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazole CAS Name: 3-(3-iodophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazole IUPAC Name: 3-(3-iodophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazole Traditional Name: 3-(3-iodophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazole Formula: C9H5F3IN3 MolecularWeight: 339.05578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)C2=NNC(=N2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)I)C2=NNC(=N2)C(F)(F)F

InChI

InChI=1S/C9H5F3IN3/c10-9(11,12)8-14-7(15-16-8)5-2-1-3-6(13)4-5/h1-4H,(H,14,15,16)