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

Systemtic Name: phenyl 4-(2-hydroxyphenyl)-1-phenyl-pyrrole-3-sulfonate Openeye Name: phenyl 4-(2-hydroxyphenyl)-1-phenyl-pyrrole-3-sulfonate CAS Name: 4-(2-hydroxyphenyl)-1-phenyl-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 4-(2-hydroxyphenyl)-1-phenylpyrrole-3-sulfonate Traditional Name: 4-(2-hydroxyphenyl)-1-phenyl-pyrrole-3-sulfonic acid phenyl ester Formula: C22H17NO4S MolecularWeight: 391.43968

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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)C4=CC=CC=C4O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=C2)S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C22H17NO4S/c24-21-14-8-7-13-19(21)20-15-23(17-9-3-1-4-10-17)16-22(20)28(25,26)27-18-11-5-2-6-12-18/h1-16,24H