2-[2-(4-methylphenyl)sulfonyl-4-phenoxy-phenoxy]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[2-(4-methylphenyl)sulfonyl-4-phenoxy-phenoxy]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[4-phenoxy-2-(p-tolylsulfonyl)phenoxy]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[2-(4-methylphenyl)sulfonyl-4-phenoxyphenoxy]ethyl ester IUPAC Name: 2-[2-(4-methylphenyl)sulfonyl-4-phenoxyphenoxy]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(4-phenoxy-2-tosyl-phenoxy)ethyl ester Formula: C28H26O7S2 MolecularWeight: 538.63184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)OC3=CC=CC=C3)OCCOS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)OC3=CC=CC=C3)OCCOS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H26O7S2/c1-21-8-13-25(14-9-21)36(29,30)28-20-24(35-23-6-4-3-5-7-23)12-17-27(28)33-18-19-34-37(31,32)26-15-10-22(2)11-16-26/h3-17,20H,18-19H2,1-2H3