[4-[4-(thiiran-2-ylmethylsulfonyl)phenoxy]phenyl] 4-methoxybenzenesulfonate

Systemtic Name: [4-[4-(thiiran-2-ylmethylsulfonyl)phenoxy]phenyl] 4-methoxybenzenesulfonate Openeye Name: [4-[4-(thiiran-2-ylmethylsulfonyl)phenoxy]phenyl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [4-[4-(2-thiiranylmethylsulfonyl)phenoxy]phenyl] ester IUPAC Name: [4-[4-(thiiran-2-ylmethylsulfonyl)phenoxy]phenyl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid [4-[4-(thiiran-2-ylmethylsulfonyl)phenoxy]phenyl] ester Formula: C22H20O7S3 MolecularWeight: 492.585

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)CC4CS4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)OC3=CC=C(C=C3)S(=O)(=O)CC4CS4

InChI

InChI=1S/C22H20O7S3/c1-27-16-6-12-22(13-7-16)32(25,26)29-19-4-2-17(3-5-19)28-18-8-10-21(11-9-18)31(23,24)15-20-14-30-20/h2-13,20H,14-15H2,1H3