1-(3-chloranyl-4-methyl-phenyl)-5-ethyl-pyrazole-3-carboxylate

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-5-ethyl-pyrazole-3-carboxylate Openeye Name: 1-(3-chloro-4-methyl-phenyl)-5-ethyl-pyrazole-3-carboxylate CAS Name: 1-(3-chloro-4-methylphenyl)-5-ethyl-3-pyrazolecarboxylate IUPAC Name: 1-(3-chloro-4-methylphenyl)-5-ethylpyrazole-3-carboxylate Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-ethyl-pyrazole-3-carboxylate Formula: C13H12ClN2O2- MolecularWeight: 263.69958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1C2=CC(=C(C=C2)C)Cl)C(=O)[O-]

Isomeric SMILES

CCC1=CC(=NN1C2=CC(=C(C=C2)C)Cl)C(=O)[O-]

InChI

InChI=1S/C13H13ClN2O2/c1-3-9-7-12(13(17)18)15-16(9)10-5-4-8(2)11(14)6-10/h4-7H,3H2,1-2H3,(H,17,18)/p-1