(4-methoxyphenyl) 4-(2,6-dicyanophenoxy)benzenesulfonate

Systemtic Name: (4-methoxyphenyl) 4-(2,6-dicyanophenoxy)benzenesulfonate Openeye Name: (4-methoxyphenyl) 4-(2,6-dicyanophenoxy)benzenesulfonate CAS Name: 4-(2,6-dicyanophenoxy)benzenesulfonic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 4-(2,6-dicyanophenoxy)benzenesulfonate Traditional Name: 4-(2,6-dicyanophenoxy)benzenesulfonic acid (4-methoxyphenyl) ester Formula: C21H14N2O5S MolecularWeight: 406.41126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)OC3=C(C=CC=C3C#N)C#N

Isomeric SMILES

COC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)OC3=C(C=CC=C3C#N)C#N

InChI

InChI=1S/C21H14N2O5S/c1-26-17-5-7-19(8-6-17)28-29(24,25)20-11-9-18(10-12-20)27-21-15(13-22)3-2-4-16(21)14-23/h2-12H,1H3