1-(3-chloranyl-4-fluoranyl-phenyl)-3-ethyl-5-propyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-ethyl-5-propyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-ethyl-5-propyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chloro-4-fluorophenyl)-3-ethyl-5-propyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-ethyl-5-propylpyrazole-4-carboxylic acid Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-ethyl-5-propyl-pyrazole-4-carboxylic acid Formula: C15H16ClFN2O2 MolecularWeight: 310.751143

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C2=CC(=C(C=C2)F)Cl)CC)C(=O)O

Isomeric SMILES

CCCC1=C(C(=NN1C2=CC(=C(C=C2)F)Cl)CC)C(=O)O

InChI

InChI=1S/C15H16ClFN2O2/c1-3-5-13-14(15(20)21)12(4-2)18-19(13)9-6-7-11(17)10(16)8-9/h6-8H,3-5H2,1-2H3,(H,20,21)