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1,2,3-trinitrobenzene sulfate

1,2,3-trinitrobenzene sulfate

Systemtic Name:1,2,3-trinitrobenzene sulfate
Openeye Name:1,2,3-trinitrobenzene sulfate
CAS Name:1,2,3-trinitrobenzene sulfate
IUPAC Name:1,2,3-trinitrobenzene sulfate
Traditional Name:1,2,3-trinitrobenzene sulfate
Formula: C6H3N3O10S-2
MolecularWeight: 309.16712
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].[O-]S(=O)(=O)[O-]


Isomeric SMILES

C1=CC(=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].[O-]S(=O)(=O)[O-]


InChI

InChI=1S/C6H3N3O6.H2O4S/c10-7(11)4-2-1-3-5(8(12)13)6(4)9(14)15;1-5(2,3)4/h1-3H;(H2,1,2,3,4)/p-2


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