phenyl 3-methylsulfanyl-4-oxidanyl-pyrrole-1-sulfonate

Systemtic Name: phenyl 3-methylsulfanyl-4-oxidanyl-pyrrole-1-sulfonate Openeye Name: phenyl 3-hydroxy-4-methylsulfanyl-pyrrole-1-sulfonate CAS Name: 3-hydroxy-4-(methylthio)-1-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 3-hydroxy-4-methylsulfanylpyrrole-1-sulfonate Traditional Name: 3-hydroxy-4-(methylthio)pyrrole-1-sulfonic acid phenyl ester Formula: C11H11NO4S2 MolecularWeight: 285.33934

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CN(C=C1O)S(=O)(=O)OC2=CC=CC=C2

Isomeric SMILES

CSC1=CN(C=C1O)S(=O)(=O)OC2=CC=CC=C2

InChI

InChI=1S/C11H11NO4S2/c1-17-11-8-12(7-10(11)13)18(14,15)16-9-5-3-2-4-6-9/h2-8,13H,1H3