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1,3-dimethyl-2-(nitromethylsulfanyl)benzene

1,3-dimethyl-2-(nitromethylsulfanyl)benzene

Systemtic Name:1,3-dimethyl-2-(nitromethylsulfanyl)benzene
Openeye Name:1,3-dimethyl-2-(nitromethylsulfanyl)benzene
CAS Name:1,3-dimethyl-2-(nitromethylthio)benzene
IUPAC Name:1,3-dimethyl-2-(nitromethylsulfanyl)benzene
Traditional Name:1,3-dimethyl-2-(nitromethylthio)benzene
Formula: C9H11NO2S
MolecularWeight: 197.25414
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)SC[N+](=O)[O-]


Isomeric SMILES

CC1=C(C(=CC=C1)C)SC[N+](=O)[O-]


InChI

InChI=1S/C9H11NO2S/c1-7-4-3-5-8(2)9(7)13-6-10(11)12/h3-5H,6H2,1-2H3


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