phenyl 1,4-bis(2-hydroxyphenyl)pyrrole-3-sulfonate

Systemtic Name: phenyl 1,4-bis(2-hydroxyphenyl)pyrrole-3-sulfonate Openeye Name: phenyl 1,4-bis(2-hydroxyphenyl)pyrrole-3-sulfonate CAS Name: 1,4-bis(2-hydroxyphenyl)-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 1,4-bis(2-hydroxyphenyl)pyrrole-3-sulfonate Traditional Name: 1,4-bis(2-hydroxyphenyl)pyrrole-3-sulfonic acid phenyl ester Formula: C22H17NO5S MolecularWeight: 407.43908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)C2=CN(C=C2C3=CC=CC=C3O)C4=CC=CC=C4O

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)C2=CN(C=C2C3=CC=CC=C3O)C4=CC=CC=C4O

InChI

InChI=1S/C22H17NO5S/c24-20-12-6-4-10-17(20)18-14-23(19-11-5-7-13-21(19)25)15-22(18)29(26,27)28-16-8-2-1-3-9-16/h1-15,24-25H