4-(4-pyrrol-1-ylphenoxy)benzenesulfonic acid

Systemtic Name: 4-(4-pyrrol-1-ylphenoxy)benzenesulfonic acid Openeye Name: 4-(4-pyrrol-1-ylphenoxy)benzenesulfonic acid CAS Name: 4-[4-(1-pyrrolyl)phenoxy]benzenesulfonic acid IUPAC Name: 4-(4-pyrrol-1-ylphenoxy)benzenesulfonic acid Traditional Name: 4-(4-pyrrol-1-ylphenoxy)besylic acid Formula: C16H13NO4S MolecularWeight: 315.34372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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