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2,4,6-trinitrophenolate sulfate

2,4,6-trinitrophenolate sulfate

Systemtic Name:2,4,6-trinitrophenolate sulfate
Openeye Name:2,4,6-trinitrophenolate sulfate
CAS Name:2,4,6-trinitrophenolate sulfate
IUPAC Name:2,4,6-trinitrophenolate sulfate
Traditional Name:picrate sulfate
Formula: C6H2N3O11S-3
MolecularWeight: 324.15858
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C6H3N3O7.H2O4S/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;1-5(2,3)4/h1-2,10H;(H2,1,2,3,4)/p-3


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