methyl 5-(4-chlorophenyl)-3-methyl-5-oxidanyl-4H-pyrazole-1-carboxylate

Systemtic Name: methyl 5-(4-chlorophenyl)-3-methyl-5-oxidanyl-4H-pyrazole-1-carboxylate Openeye Name: methyl 5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazole-1-carboxylate CAS Name: 5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazole-1-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazole-1-carboxylate Traditional Name: 5-(4-chlorophenyl)-5-hydroxy-3-methyl-2-pyrazoline-1-carboxylic acid methyl ester Formula: C12H13ClN2O3 MolecularWeight: 268.69622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C2=CC=C(C=C2)Cl)O)C(=O)OC

Isomeric SMILES

CC1=NN(C(C1)(C2=CC=C(C=C2)Cl)O)C(=O)OC

InChI

InChI=1S/C12H13ClN2O3/c1-8-7-12(17,15(14-8)11(16)18-2)9-3-5-10(13)6-4-9/h3-6,17H,7H2,1-2H3