methyl 5-chloranyl-4-[(E)-hydroxyiminomethyl]-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: methyl 5-chloranyl-4-[(E)-hydroxyiminomethyl]-1-phenyl-pyrazole-3-carboxylate Openeye Name: methyl 5-chloro-4-[(E)-hydroxyiminomethyl]-1-phenyl-pyrazole-3-carboxylate CAS Name: 5-chloro-4-[(E)-hydroxyiminomethyl]-1-phenyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-chloro-4-[(E)-hydroxyiminomethyl]-1-phenylpyrazole-3-carboxylate Traditional Name: 5-chloro-4-[(E)-hydroximinomethyl]-1-phenyl-pyrazole-3-carboxylic acid methyl ester Formula: C12H10ClN3O3 MolecularWeight: 279.6791

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C(=C1C=NO)Cl)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C12H10ClN3O3/c1-19-12(17)10-9(7-14-18)11(13)16(15-10)8-5-3-2-4-6-8/h2-7,18H,1H3/b14-7+