1-(3-chloranyl-4-fluoranyl-phenyl)-3,5-diethyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3,5-diethyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3,5-diethyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chloro-4-fluorophenyl)-3,5-diethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3,5-diethylpyrazole-4-carboxylic acid Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3,5-diethyl-pyrazole-4-carboxylic acid Formula: C14H14ClFN2O2 MolecularWeight: 296.724563

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC(=C(C=C2)F)Cl)CC)C(=O)O

Isomeric SMILES

CCC1=C(C(=NN1C2=CC(=C(C=C2)F)Cl)CC)C(=O)O

InChI

InChI=1S/C14H14ClFN2O2/c1-3-11-13(14(19)20)12(4-2)18(17-11)8-5-6-10(16)9(15)7-8/h5-7H,3-4H2,1-2H3,(H,19,20)