5-(trichloromethyl)-1H-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 5-(trichloromethyl)-1H-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-(trichloromethyl)-1H-1,2,4-triazole-3-carboxylic acid CAS Name: 5-(trichloromethyl)-1H-1,2,4-triazole-3-carboxylic acid IUPAC Name: 5-(trichloromethyl)-1H-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-(trichloromethyl)-1H-1,2,4-triazole-3-carboxylic acid Formula: C4H2Cl3N3O2 MolecularWeight: 230.43658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H2Cl3N3O2/c5-4(6,7)3-8-1(2(11)12)9-10-3/h(H,11,12)(H,8,9,10)