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

Systemtic Name: phenyl 4-(2-hydroxyphenyl)-1-(phenylmethyl)pyrrole-3-sulfonate Openeye Name: phenyl 1-benzyl-4-(2-hydroxyphenyl)pyrrole-3-sulfonate CAS Name: 4-(2-hydroxyphenyl)-1-(phenylmethyl)-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 1-benzyl-4-(2-hydroxyphenyl)pyrrole-3-sulfonate Traditional Name: 1-benzyl-4-(2-hydroxyphenyl)pyrrole-3-sulfonic acid phenyl ester Formula: C23H19NO4S MolecularWeight: 405.46626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=C2)S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=C2)S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C23H19NO4S/c25-22-14-8-7-13-20(22)21-16-24(15-18-9-3-1-4-10-18)17-23(21)29(26,27)28-19-11-5-2-6-12-19/h1-14,16-17,25H,15H2