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5-[6-bromanyl-5-(methylsulfonyloxymethyl)pyridin-3-yl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole-1-carboxylate

5-[6-bromanyl-5-(methylsulfonyloxymethyl)pyridin-3-yl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole-1-carboxylate

Systemtic Name:5-[6-bromanyl-5-(methylsulfonyloxymethyl)pyridin-3-yl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole-1-carboxylate
Openeye Name:5-[6-bromo-5-(methylsulfonyloxymethyl)-3-pyridyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole-1-carboxylate
CAS Name:5-[6-bromo-5-(methylsulfonyloxymethyl)-3-pyridinyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole-1-carboxylate
IUPAC Name:5-[6-bromo-5-(methylsulfonyloxymethyl)pyridin-3-yl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole-1-carboxylate
Traditional Name:5-[6-bromo-5-(methylsulfonyloxymethyl)-3-pyridyl]-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole-1-carboxylate
Formula: C14H17BrN3O5S-
MolecularWeight: 419.27088
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1=CC(=CN=C1Br)N2CC3CCN(C3C2)C(=O)[O-]


Isomeric SMILES

CS(=O)(=O)OCC1=CC(=CN=C1Br)N2CC3CCN(C3C2)C(=O)[O-]


InChI

InChI=1S/C14H18BrN3O5S/c1-24(21,22)23-8-10-4-11(5-16-13(10)15)17-6-9-2-3-18(14(19)20)12(9)7-17/h4-5,9,12H,2-3,6-8H2,1H3,(H,19,20)/p-1


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