methyl 4-chloranyl-5-(4-chloranyl-2-fluoranyl-5-nitro-phenyl)-2-methyl-pyrazole-3-carboxylate

Systemtic Name: methyl 4-chloranyl-5-(4-chloranyl-2-fluoranyl-5-nitro-phenyl)-2-methyl-pyrazole-3-carboxylate Openeye Name: methyl 4-chloro-5-(4-chloro-2-fluoro-5-nitro-phenyl)-2-methyl-pyrazole-3-carboxylate CAS Name: 4-chloro-5-(4-chloro-2-fluoro-5-nitrophenyl)-2-methyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-chloro-5-(4-chloro-2-fluoro-5-nitrophenyl)-2-methylpyrazole-3-carboxylate Traditional Name: 4-chloro-5-(4-chloro-2-fluoro-5-nitro-phenyl)-2-methyl-pyrazole-3-carboxylic acid methyl ester Formula: C12H8Cl2FN3O4 MolecularWeight: 348.114023

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC(=C(C=C2F)Cl)[N+](=O)[O-])Cl)C(=O)OC

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC(=C(C=C2F)Cl)[N+](=O)[O-])Cl)C(=O)OC

InChI

InChI=1S/C12H8Cl2FN3O4/c1-17-11(12(19)22-2)9(14)10(16-17)5-3-8(18(20)21)6(13)4-7(5)15/h3-4H,1-2H3