phenyl 2-[4-(4-cyanophenyl)phenoxy]ethanesulfonate

Systemtic Name: phenyl 2-[4-(4-cyanophenyl)phenoxy]ethanesulfonate Openeye Name: phenyl 2-[4-(4-cyanophenyl)phenoxy]ethanesulfonate CAS Name: 2-[4-(4-cyanophenyl)phenoxy]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-[4-(4-cyanophenyl)phenoxy]ethanesulfonate Traditional Name: 2-[4-(4-cyanophenyl)phenoxy]ethanesulfonic acid phenyl ester Formula: C21H17NO4S MolecularWeight: 379.42898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)CCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)CCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H17NO4S/c22-16-17-6-8-18(9-7-17)19-10-12-20(13-11-19)25-14-15-27(23,24)26-21-4-2-1-3-5-21/h1-13H,14-15H2