ethyl 5-[[2,6-bis(bromanyl)-4-nitro-phenyl]carbamoyl]-2-methyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[[2,6-bis(bromanyl)-4-nitro-phenyl]carbamoyl]-2-methyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-[(2,6-dibromo-4-nitro-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylate CAS Name: 5-[(2,6-dibromo-4-nitroanilino)-oxomethyl]-2-methyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2,6-dibromo-4-nitrophenyl)carbamoyl]-2-methylpyrazole-3-carboxylate Traditional Name: 5-[(2,6-dibromo-4-nitro-phenyl)carbamoyl]-2-methyl-pyrazole-3-carboxylic acid ethyl ester Formula: C14H12Br2N4O5 MolecularWeight: 476.07688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C)C(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br

InChI

InChI=1S/C14H12Br2N4O5/c1-3-25-14(22)11-6-10(18-19(11)2)13(21)17-12-8(15)4-7(20(23)24)5-9(12)16/h4-6H,3H2,1-2H3,(H,17,21)