methyl 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)ethanoate

Systemtic Name: methyl 2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)ethanoate Openeye Name: methyl 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetate CAS Name: 2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)acetic acid methyl ester IUPAC Name: methyl 2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)acetate Traditional Name: 2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetic acid methyl ester Formula: C7H8BrN3O4 MolecularWeight: 278.06012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)OC)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)OC)[N+](=O)[O-])Br

InChI

InChI=1S/C7H8BrN3O4/c1-4-6(8)7(11(13)14)9-10(4)3-5(12)15-2/h3H2,1-2H3