methyl 5-chloranyl-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: methyl 5-chloranyl-1-phenyl-pyrazole-3-carboxylate Openeye Name: methyl 5-chloro-1-phenyl-pyrazole-3-carboxylate CAS Name: 5-chloro-1-phenyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-chloro-1-phenylpyrazole-3-carboxylate Traditional Name: 5-chloro-1-phenyl-pyrazole-3-carboxylic acid methyl ester Formula: C11H9ClN2O2 MolecularWeight: 236.65436

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C(=C1)Cl)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=NN(C(=C1)Cl)C2=CC=CC=C2

InChI

InChI=1S/C11H9ClN2O2/c1-16-11(15)9-7-10(12)14(13-9)8-5-3-2-4-6-8/h2-7H,1H3