ethyl 4-bromanyl-3-nitro-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 4-bromanyl-3-nitro-1H-pyrazole-5-carboxylate Openeye Name: ethyl 4-bromo-3-nitro-1H-pyrazole-5-carboxylate CAS Name: 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-bromo-3-nitro-1H-pyrazole-5-carboxylate Traditional Name: 4-bromo-3-nitro-1H-pyrazole-5-carboxylic acid ethyl ester Formula: C6H6BrN3O4 MolecularWeight: 264.03354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NN1)[N+](=O)[O-])Br

Isomeric SMILES

CCOC(=O)C1=C(C(=NN1)[N+](=O)[O-])Br

InChI

InChI=1S/C6H6BrN3O4/c1-2-14-6(11)4-3(7)5(9-8-4)10(12)13/h2H2,1H3,(H,8,9)