propan-2-yl 2,4-bis-(4-methylphenyl)sulfonyloxybutanoate

Systemtic Name: propan-2-yl 2,4-bis-(4-methylphenyl)sulfonyloxybutanoate Openeye Name: isopropyl 2,4-bis(p-tolylsulfonyloxy)butanoate CAS Name: 2,4-bis-(4-methylphenyl)sulfonyloxybutanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,4-bis-(4-methylphenyl)sulfonyloxybutanoate Traditional Name: 2,4-ditosyloxybutyric acid isopropyl ester Formula: C21H26O8S2 MolecularWeight: 470.55634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C(=O)OC(C)C)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C(=O)OC(C)C)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H26O8S2/c1-15(2)28-21(22)20(29-31(25,26)19-11-7-17(4)8-12-19)13-14-27-30(23,24)18-9-5-16(3)6-10-18/h5-12,15,20H,13-14H2,1-4H3