methyl 1-(4-chlorophenyl)-4,5-bis(oxidanylidene)pyrazole-3-carboxylate

Systemtic Name: methyl 1-(4-chlorophenyl)-4,5-bis(oxidanylidene)pyrazole-3-carboxylate Openeye Name: methyl 1-(4-chlorophenyl)-4,5-dioxo-pyrazole-3-carboxylate CAS Name: 1-(4-chlorophenyl)-4,5-dioxo-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-chlorophenyl)-4,5-dioxopyrazole-3-carboxylate Traditional Name: 1-(4-chlorophenyl)-4,5-diketo-2-pyrazoline-3-carboxylic acid methyl ester Formula: C11H7ClN2O4 MolecularWeight: 266.63728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H7ClN2O4/c1-18-11(17)8-9(15)10(16)14(13-8)7-4-2-6(12)3-5-7/h2-5H,1H3