methyl 2-[3,5-bis(bromanyl)-4-nitro-pyrazol-1-yl]ethanoate

Systemtic Name: methyl 2-[3,5-bis(bromanyl)-4-nitro-pyrazol-1-yl]ethanoate Openeye Name: methyl 2-(3,5-dibromo-4-nitro-pyrazol-1-yl)acetate CAS Name: 2-(3,5-dibromo-4-nitro-1-pyrazolyl)acetic acid methyl ester IUPAC Name: methyl 2-(3,5-dibromo-4-nitropyrazol-1-yl)acetate Traditional Name: 2-(3,5-dibromo-4-nitro-pyrazol-1-yl)acetic acid methyl ester Formula: C6H5Br2N3O4 MolecularWeight: 342.9296

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=C(C(=N1)Br)[N+](=O)[O-])Br

Isomeric SMILES

COC(=O)CN1C(=C(C(=N1)Br)[N+](=O)[O-])Br

InChI

InChI=1S/C6H5Br2N3O4/c1-15-3(12)2-10-6(8)4(11(13)14)5(7)9-10/h2H2,1H3