5-tert-butyl-7-chloranyl-6-(2-chloroethyl)-3-nitro-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 5-tert-butyl-7-chloranyl-6-(2-chloroethyl)-3-nitro-pyrazolo[1,5-a]pyrimidine Openeye Name: 5-tert-butyl-7-chloro-6-(2-chloroethyl)-3-nitro-pyrazolo[1,5-a]pyrimidine CAS Name: 5-tert-butyl-7-chloro-6-(2-chloroethyl)-3-nitropyrazolo[1,5-a]pyrimidine IUPAC Name: 5-tert-butyl-7-chloro-6-(2-chloroethyl)-3-nitropyrazolo[1,5-a]pyrimidine Traditional Name: 5-tert-butyl-7-chloro-6-(2-chloroethyl)-3-nitro-pyrazolo[1,5-a]pyrimidine Formula: C12H14Cl2N4O2 MolecularWeight: 317.17116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C=NN2C(=C1CCCl)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NC2=C(C=NN2C(=C1CCCl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H14Cl2N4O2/c1-12(2,3)9-7(4-5-13)10(14)17-11(16-9)8(6-15-17)18(19)20/h6H,4-5H2,1-3H3