ethyl 3-bromanyl-6-(4-nitro-1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylate

Systemtic Name: ethyl 3-bromanyl-6-(4-nitro-1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylate Openeye Name: ethyl 3-bromo-6-(4-nitro-1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylate CAS Name: 3-bromo-6-(4-nitro-1H-pyrazol-5-yl)-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-bromo-6-(4-nitro-1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylate Traditional Name: 3-bromo-6-(4-nitro-1H-pyrazol-5-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid ethyl ester Formula: C12H9BrN6O4 MolecularWeight: 381.14166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN2C=C(C=NC2=C1Br)C3=C(C=NN3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN2C=C(C=NC2=C1Br)C3=C(C=NN3)[N+](=O)[O-]

InChI

InChI=1S/C12H9BrN6O4/c1-2-23-12(20)10-8(13)11-14-3-6(5-18(11)17-10)9-7(19(21)22)4-15-16-9/h3-5H,2H2,1H3,(H,15,16)