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

Systemtic Name: phenyl 4-oxidanyl-1-phenyl-pyrrole-3-sulfonate Openeye Name: phenyl 4-hydroxy-1-phenyl-pyrrole-3-sulfonate CAS Name: 4-hydroxy-1-phenyl-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 4-hydroxy-1-phenylpyrrole-3-sulfonate Traditional Name: 4-hydroxy-1-phenyl-pyrrole-3-sulfonic acid phenyl ester Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=C2)S(=O)(=O)OC3=CC=CC=C3)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=C2)S(=O)(=O)OC3=CC=CC=C3)O

InChI

InChI=1S/C16H13NO4S/c18-15-11-17(13-7-3-1-4-8-13)12-16(15)22(19,20)21-14-9-5-2-6-10-14/h1-12,18H