4,6-dinitro-5-oxidanyl-1,3-benzoxathiol-2-one

Systemtic Name: 4,6-dinitro-5-oxidanyl-1,3-benzoxathiol-2-one Openeye Name: 5-hydroxy-4,6-dinitro-1,3-benzoxathiol-2-one CAS Name: 5-hydroxy-4,6-dinitro-1,3-benzoxathiol-2-one IUPAC Name: 5-hydroxy-4,6-dinitro-1,3-benzoxathiol-2-one Traditional Name: 5-hydroxy-4,6-dinitro-1,3-benzoxathiol-2-one Formula: C7H2N2O7S MolecularWeight: 258.16498

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C2=C1OC(=O)S2)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=C(C2=C1OC(=O)S2)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C7H2N2O7S/c10-5-2(8(12)13)1-3-6(4(5)9(14)15)17-7(11)16-3/h1,10H