1-(4-chloranyl-2-fluoranyl-phenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 1-(4-chloranyl-2-fluoranyl-phenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid Openeye Name: 1-(4-chloro-2-fluoro-phenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid CAS Name: 1-(4-chloro-2-fluorophenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid IUPAC Name: 1-(4-chloro-2-fluorophenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid Traditional Name: 1-(4-chloro-2-fluoro-phenyl)-5-cyclopropyl-1,2,4-triazole-3-carboxylic acid Formula: C12H9ClFN3O2 MolecularWeight: 281.670163

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NN2C3=C(C=C(C=C3)Cl)F)C(=O)O

Isomeric SMILES

C1CC1C2=NC(=NN2C3=C(C=C(C=C3)Cl)F)C(=O)O

InChI

InChI=1S/C12H9ClFN3O2/c13-7-3-4-9(8(14)5-7)17-11(6-1-2-6)15-10(16-17)12(18)19/h3-6H,1-2H2,(H,18,19)