4-methylbenzenesulfonate; [4-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethoxy]phenyl]-diphenyl-sulfanium

Systemtic Name: 4-methylbenzenesulfonate; [4-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethoxy]phenyl]-diphenyl-sulfanium Openeye Name: [4-(2-tert-butoxy-2-oxo-ethoxy)phenyl]-diphenyl-sulfonium; 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonate; [4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]phenyl]-diphenylsulfonium IUPAC Name: 4-methylbenzenesulfonate; [4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]phenyl]-diphenylsulfanium Traditional Name: [4-(2-tert-butoxy-2-keto-ethoxy)phenyl]-diphenyl-sulfonium tosylate Formula: C31H32O6S2 MolecularWeight: 564.71218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC(C)(C)OC(=O)COC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC(C)(C)OC(=O)COC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H25O3S.C7H8O3S/c1-24(2,3)27-23(25)18-26-19-14-16-22(17-15-19)28(20-10-6-4-7-11-20)21-12-8-5-9-13-21;1-6-2-4-7(5-3-6)11(8,9)10/h4-17H,18H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1