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(1-butan-2-ylsulfanyl-2-nitro-ethyl)benzene

(1-butan-2-ylsulfanyl-2-nitro-ethyl)benzene

Systemtic Name:(1-butan-2-ylsulfanyl-2-nitro-ethyl)benzene
Openeye Name:(2-nitro-1-sec-butylsulfanyl-ethyl)benzene
CAS Name:[1-(butan-2-ylthio)-2-nitroethyl]benzene
IUPAC Name:(1-butan-2-ylsulfanyl-2-nitroethyl)benzene
Traditional Name:[2-nitro-1-(sec-butylthio)ethyl]benzene
Formula: C12H17NO2S
MolecularWeight: 239.33388
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H17NO2S/c1-3-10(2)16-12(9-13(14)15)11-7-5-4-6-8-11/h4-8,10,12H,3,9H2,1-2H3


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