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5-(nitromethylsulfonyl)-1-benzothiophene

5-(nitromethylsulfonyl)-1-benzothiophene

Systemtic Name:5-(nitromethylsulfonyl)-1-benzothiophene
Openeye Name:5-(nitromethylsulfonyl)benzothiophene
CAS Name:5-(nitromethylsulfonyl)-1-benzothiophene
IUPAC Name:5-(nitromethylsulfonyl)-1-benzothiophene
Traditional Name:5-(nitromethylsulfonyl)benzothiophene
Formula: C9H7NO4S2
MolecularWeight: 257.28618
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CS2)C=C1S(=O)(=O)C[N+](=O)[O-]


Isomeric SMILES

C1=CC2=C(C=CS2)C=C1S(=O)(=O)C[N+](=O)[O-]


InChI

InChI=1S/C9H7NO4S2/c11-10(12)6-16(13,14)8-1-2-9-7(5-8)3-4-15-9/h1-5H,6H2


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