methyl 5-(2-chloranyl-5-nitro-phenyl)carbonyloxy-1-methyl-pyrazole-3-carboxylate

Systemtic Name: methyl 5-(2-chloranyl-5-nitro-phenyl)carbonyloxy-1-methyl-pyrazole-3-carboxylate Openeye Name: methyl 5-(2-chloro-5-nitro-benzoyl)oxy-1-methyl-pyrazole-3-carboxylate CAS Name: 5-[(2-chloro-5-nitrophenyl)-oxomethoxy]-1-methyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(2-chloro-5-nitrobenzoyl)oxy-1-methylpyrazole-3-carboxylate Traditional Name: 5-(2-chloro-5-nitro-benzoyl)oxy-1-methyl-pyrazole-3-carboxylic acid methyl ester Formula: C13H10ClN3O6 MolecularWeight: 339.688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10ClN3O6/c1-16-11(6-10(15-16)13(19)22-2)23-12(18)8-5-7(17(20)21)3-4-9(8)14/h3-6H,1-2H3