phenyl 3-(2-hydroxyphenyl)-4-oxidanyl-pyrrole-1-sulfonate

Systemtic Name: phenyl 3-(2-hydroxyphenyl)-4-oxidanyl-pyrrole-1-sulfonate Openeye Name: phenyl 3-hydroxy-4-(2-hydroxyphenyl)pyrrole-1-sulfonate CAS Name: 3-hydroxy-4-(2-hydroxyphenyl)-1-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 3-hydroxy-4-(2-hydroxyphenyl)pyrrole-1-sulfonate Traditional Name: 3-hydroxy-4-(2-hydroxyphenyl)pyrrole-1-sulfonic acid phenyl ester Formula: C16H13NO5S MolecularWeight: 331.34312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)N2C=C(C(=C2)O)C3=CC=CC=C3O

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)N2C=C(C(=C2)O)C3=CC=CC=C3O

InChI

InChI=1S/C16H13NO5S/c18-15-9-5-4-8-13(15)14-10-17(11-16(14)19)23(20,21)22-12-6-2-1-3-7-12/h1-11,18-19H