(2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate

Systemtic Name: (2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate Openeye Name: (2-methoxy-2-oxo-1-phenyl-ethyl) 5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxylic acid (2-methoxy-2-oxo-1-phenylethyl) ester IUPAC Name: (2-methoxy-2-oxo-1-phenylethyl) 5-chloro-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxylate Traditional Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylic acid (2-keto-2-methoxy-1-phenyl-ethyl) ester Formula: C20H16ClFN2O4 MolecularWeight: 402.803443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OC(C2=CC=CC=C2)C(=O)OC)Cl)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)OC(C2=CC=CC=C2)C(=O)OC)Cl)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H16ClFN2O4/c1-12-16(18(21)24(23-12)15-10-8-14(22)9-11-15)19(25)28-17(20(26)27-2)13-6-4-3-5-7-13/h3-11,17H,1-2H3