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

Systemtic Name: 5-(trifluoromethyl)-1H-1,2,4-triazole-3-carbonyl chloride Openeye Name: 5-(trifluoromethyl)-1H-1,2,4-triazole-3-carbonyl chloride CAS Name: 5-(trifluoromethyl)-1H-1,2,4-triazole-3-carbonyl chloride IUPAC Name: 5-(trifluoromethyl)-1H-1,2,4-triazole-3-carbonyl chloride Traditional Name: 5-(trifluoromethyl)-1H-1,2,4-triazole-3-carbonyl chloride Formula: C4HClF3N3O MolecularWeight: 199.51845

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Descriptors Computed from Structure

Canonical SMILES:

C1(=NNC(=N1)C(F)(F)F)C(=O)Cl

Isomeric SMILES

C1(=NNC(=N1)C(F)(F)F)C(=O)Cl

InChI

InChI=1S/C4HClF3N3O/c5-1(12)2-9-3(11-10-2)4(6,7)8/h(H,9,10,11)