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

Systemtic Name: phenyl 4-(2-hydroxyphenyl)-1-methyl-pyrrole-3-sulfonate Openeye Name: phenyl 4-(2-hydroxyphenyl)-1-methyl-pyrrole-3-sulfonate CAS Name: 4-(2-hydroxyphenyl)-1-methyl-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 4-(2-hydroxyphenyl)-1-methylpyrrole-3-sulfonate Traditional Name: 4-(2-hydroxyphenyl)-1-methyl-pyrrole-3-sulfonic acid phenyl ester Formula: C17H15NO4S MolecularWeight: 329.3703

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=C1)S(=O)(=O)OC2=CC=CC=C2)C3=CC=CC=C3O

Isomeric SMILES

CN1C=C(C(=C1)S(=O)(=O)OC2=CC=CC=C2)C3=CC=CC=C3O

InChI

InChI=1S/C17H15NO4S/c1-18-11-15(14-9-5-6-10-16(14)19)17(12-18)23(20,21)22-13-7-3-2-4-8-13/h2-12,19H,1H3