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1,2-dinitro-3-oxidanylsulfanyl-benzene

1,2-dinitro-3-oxidanylsulfanyl-benzene

Systemtic Name:1,2-dinitro-3-oxidanylsulfanyl-benzene
Openeye Name:1-hydroxysulfanyl-2,3-dinitro-benzene
CAS Name:2,3-dinitrobenzenesulfenic acid
IUPAC Name:1-hydroxysulfanyl-2,3-dinitrobenzene
Traditional Name:1,2-dinitro-3-sulfeno-benzene
Formula: C6H4N2O5S
MolecularWeight: 216.17136
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C6H4N2O5S/c9-7(10)4-2-1-3-5(14-13)6(4)8(11)12/h1-3,13H


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