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The molecular formula is C13H12N2O6S.
The compound was created on March 15, 2010, and modified on December 30, 2023.
The IUPAC name is methyl 1-(4-methylphenyl)sulfonyl-4-nitropyrrole-2-carboxylate.
The InChIKey is AYFBDJWRDWDJJZ-UHFFFAOYSA-N.
The compound has 6 hydrogen bond acceptors.
The exact mass is 324.04160728 g/mol.
There are 4 rotatable bond counts.
The topological polar surface area is 120 Å2.
Yes, the compound is canonicalized.
The complexity value is 530.
930111-11-8
930111-13-0
930111-14-1
930112-89-3
93012-30-7
93012-66-9
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