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1-(1-bromanylpropan-2-ylsulfanyl)-2,4-dinitro-benzene

1-(1-bromanylpropan-2-ylsulfanyl)-2,4-dinitro-benzene

Systemtic Name:1-(1-bromanylpropan-2-ylsulfanyl)-2,4-dinitro-benzene
Openeye Name:1-(2-bromo-1-methyl-ethyl)sulfanyl-2,4-dinitro-benzene
CAS Name:1-(1-bromopropan-2-ylthio)-2,4-dinitrobenzene
IUPAC Name:1-(1-bromopropan-2-ylsulfanyl)-2,4-dinitrobenzene
Traditional Name:1-[(2-bromo-1-methyl-ethyl)thio]-2,4-dinitro-benzene
Formula: C9H9BrN2O4S
MolecularWeight: 321.14776
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Descriptors Computed from Structure

Canonical SMILES:

CC(CBr)SC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CC(CBr)SC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C9H9BrN2O4S/c1-6(5-10)17-9-3-2-7(11(13)14)4-8(9)12(15)16/h2-4,6H,5H2,1H3


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