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5-methyl-2-(nitromethylsulfonyl)-1-benzothiophene

5-methyl-2-(nitromethylsulfonyl)-1-benzothiophene

Systemtic Name:5-methyl-2-(nitromethylsulfonyl)-1-benzothiophene
Openeye Name:5-methyl-2-(nitromethylsulfonyl)benzothiophene
CAS Name:5-methyl-2-(nitromethylsulfonyl)-1-benzothiophene
IUPAC Name:5-methyl-2-(nitromethylsulfonyl)-1-benzothiophene
Traditional Name:5-methyl-2-(nitromethylsulfonyl)benzothiophene
Formula: C10H9NO4S2
MolecularWeight: 271.31276
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=C2)S(=O)(=O)C[N+](=O)[O-]


Isomeric SMILES

CC1=CC2=C(C=C1)SC(=C2)S(=O)(=O)C[N+](=O)[O-]


InChI

InChI=1S/C10H9NO4S2/c1-7-2-3-9-8(4-7)5-10(16-9)17(14,15)6-11(12)13/h2-5H,6H2,1H3


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