2-bromanyl-4-chloranyl-1,3,5-trinitro-benzene

Systemtic Name: 2-bromanyl-4-chloranyl-1,3,5-trinitro-benzene Openeye Name: 2-bromo-4-chloro-1,3,5-trinitro-benzene CAS Name: 2-bromo-4-chloro-1,3,5-trinitrobenzene IUPAC Name: 2-bromo-4-chloro-1,3,5-trinitrobenzene Traditional Name: 2-bromo-4-chloro-1,3,5-trinitro-benzene Formula: C6HBrClN3O6 MolecularWeight: 326.44564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6HBrClN3O6/c7-4-2(9(12)13)1-3(10(14)15)5(8)6(4)11(16)17/h1H