4-bromanyl-1-(2,4,6-trinitrophenyl)pyrazole

Systemtic Name: 4-bromanyl-1-(2,4,6-trinitrophenyl)pyrazole Openeye Name: 4-bromo-1-(2,4,6-trinitrophenyl)pyrazole CAS Name: 4-bromo-1-(2,4,6-trinitrophenyl)pyrazole IUPAC Name: 4-bromo-1-(2,4,6-trinitrophenyl)pyrazole Traditional Name: 4-bromo-1-picryl-pyrazole Formula: C9H4BrN5O6 MolecularWeight: 358.06196

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])N2C=C(C=N2)Br)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])N2C=C(C=N2)Br)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H4BrN5O6/c10-5-3-11-12(4-5)9-7(14(18)19)1-6(13(16)17)2-8(9)15(20)21/h1-4H