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5-methylsulfonyl-4-nitro-thiophene-2-carboxylic acid

5-methylsulfonyl-4-nitro-thiophene-2-carboxylic acid

Systemtic Name:5-methylsulfonyl-4-nitro-thiophene-2-carboxylic acid
Openeye Name:5-methylsulfonyl-4-nitro-thiophene-2-carboxylic acid
CAS Name:5-methylsulfonyl-4-nitro-2-thiophenecarboxylic acid
IUPAC Name:5-methylsulfonyl-4-nitrothiophene-2-carboxylic acid
Traditional Name:5-mesyl-4-nitro-2-thenoic acid
Formula: C6H5NO6S2
MolecularWeight: 251.237
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(S1)C(=O)O)[N+](=O)[O-]


Isomeric SMILES

CS(=O)(=O)C1=C(C=C(S1)C(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C6H5NO6S2/c1-15(12,13)6-3(7(10)11)2-4(14-6)5(8)9/h2H,1H3,(H,8,9)


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