ethyl 5-[(2-chloranyl-5-nitro-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[(2-chloranyl-5-nitro-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[(2-chloro-5-nitro-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate CAS Name: 5-[(2-chloro-5-nitroanilino)-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-chloro-5-nitrophenyl)carbamoyl]-2-methylpyrazole-3-carboxylate Traditional Name: 5-[(2-chloro-5-nitro-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C14H13ClN4O5 MolecularWeight: 352.72982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H13ClN4O5/c1-3-24-14(21)12-7-11(17-18(12)2)13(20)16-10-6-8(19(22)23)4-5-9(10)15/h4-7H,3H2,1-2H3,(H,16,20)