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

Systemtic Name: phenyl 4-bromanyl-1-(2-hydroxyphenyl)pyrrole-3-sulfonate Openeye Name: phenyl 4-bromo-1-(2-hydroxyphenyl)pyrrole-3-sulfonate CAS Name: 4-bromo-1-(2-hydroxyphenyl)-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 4-bromo-1-(2-hydroxyphenyl)pyrrole-3-sulfonate Traditional Name: 4-bromo-1-(2-hydroxyphenyl)pyrrole-3-sulfonic acid phenyl ester Formula: C16H12BrNO4S MolecularWeight: 394.23978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)C2=CN(C=C2Br)C3=CC=CC=C3O

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)C2=CN(C=C2Br)C3=CC=CC=C3O

InChI

InChI=1S/C16H12BrNO4S/c17-13-10-18(14-8-4-5-9-15(14)19)11-16(13)23(20,21)22-12-6-2-1-3-7-12/h1-11,19H