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

Systemtic Name: methyl 2-[2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)ethanoylamino]ethanoate Openeye Name: methyl 2-[[2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetyl]amino]acetate CAS Name: 2-[[2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)acetyl]amino]acetate Traditional Name: 2-[[2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetyl]amino]acetic acid methyl ester Formula: C9H11BrN4O5 MolecularWeight: 335.11144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11BrN4O5/c1-5-8(10)9(14(17)18)12-13(5)4-6(15)11-3-7(16)19-2/h3-4H2,1-2H3,(H,11,15)