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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1C(=O)O)CC)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CCCC1=NN(C(=C1C(=O)O)CC)C2=CC(=C(C=C2)F)Cl

InChI

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