4-[4-(2-pyridin-4-ylphenoxy)phenyl]benzenesulfonic acid

Systemtic Name: 4-[4-(2-pyridin-4-ylphenoxy)phenyl]benzenesulfonic acid Openeye Name: 4-[4-[2-(4-pyridyl)phenoxy]phenyl]benzenesulfonic acid CAS Name: 4-[4-(2-pyridin-4-ylphenoxy)phenyl]benzenesulfonic acid IUPAC Name: 4-[4-(2-pyridin-4-ylphenoxy)phenyl]benzenesulfonic acid Traditional Name: 4-[4-[2-(4-pyridyl)phenoxy]phenyl]besylic acid Formula: C23H17NO4S MolecularWeight: 403.45038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H17NO4S/c25-29(26,27)21-11-7-18(8-12-21)17-5-9-20(10-6-17)28-23-4-2-1-3-22(23)19-13-15-24-16-14-19/h1-16H,(H,25,26,27)