methyl 3-bromanyl-6-(4-nitropyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylate

Systemtic Name: methyl 3-bromanyl-6-(4-nitropyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylate Openeye Name: methyl 3-bromo-6-(4-nitropyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylate CAS Name: 3-bromo-6-(4-nitro-1-pyrazolyl)-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 3-bromo-6-(4-nitropyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylate Traditional Name: 3-bromo-6-(4-nitropyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid methyl ester Formula: C11H7BrN6O4 MolecularWeight: 367.11508

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN2C=C(C=NC2=C1Br)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=NN2C=C(C=NC2=C1Br)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C11H7BrN6O4/c1-22-11(19)9-8(12)10-13-2-6(4-17(10)15-9)16-5-7(3-14-16)18(20)21/h2-5H,1H3