2-[4-(phenylsulfinyl)phenoxy]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[4-(phenylsulfinyl)phenoxy]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[4-(benzenesulfinyl)phenoxy]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[4-(benzenesulfinyl)phenoxy]ethyl ester IUPAC Name: 2-[4-(benzenesulfinyl)phenoxy]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[4-(benzenesulfinyl)phenoxy]ethyl ester Formula: C21H20O5S2 MolecularWeight: 416.5105

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)S(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)S(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H20O5S2/c1-17-7-13-21(14-8-17)28(23,24)26-16-15-25-18-9-11-20(12-10-18)27(22)19-5-3-2-4-6-19/h2-14H,15-16H2,1H3