4-[4-(4-imidazol-1-ylphenyl)phenoxy]benzenesulfonic acid

Systemtic Name: 4-[4-(4-imidazol-1-ylphenyl)phenoxy]benzenesulfonic acid Openeye Name: 4-[4-(4-imidazol-1-ylphenyl)phenoxy]benzenesulfonic acid CAS Name: 4-[4-[4-(1-imidazolyl)phenyl]phenoxy]benzenesulfonic acid IUPAC Name: 4-[4-(4-imidazol-1-ylphenyl)phenoxy]benzenesulfonic acid Traditional Name: 4-[4-(4-imidazol-1-ylphenyl)phenoxy]besylic acid Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)O)N4C=CN=C4

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)O)N4C=CN=C4

InChI

InChI=1S/C21H16N2O4S/c24-28(25,26)21-11-9-20(10-12-21)27-19-7-3-17(4-8-19)16-1-5-18(6-2-16)23-14-13-22-15-23/h1-15H,(H,24,25,26)