dimethyl-(4-phenylmethoxycarbonyloxyphenyl)sulfanium; methanesulfonate

Systemtic Name: dimethyl-(4-phenylmethoxycarbonyloxyphenyl)sulfanium; methanesulfonate Openeye Name: (4-benzyloxycarbonyloxyphenyl)-dimethyl-sulfonium; methanesulfonate CAS Name: dimethyl-(4-phenylmethoxycarbonyloxyphenyl)sulfonium; methanesulfonate IUPAC Name: dimethyl-(4-phenylmethoxycarbonyloxyphenyl)sulfanium; methanesulfonate Traditional Name: (4-carbobenzoxyoxyphenyl)-dimethyl-sulfonium mesylate Formula: C17H20O6S2 MolecularWeight: 384.4671

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Descriptors Computed from Structure

Canonical SMILES:

C[S+](C)C1=CC=C(C=C1)OC(=O)OCC2=CC=CC=C2.CS(=O)(=O)[O-]

Isomeric SMILES

C[S+](C)C1=CC=C(C=C1)OC(=O)OCC2=CC=CC=C2.CS(=O)(=O)[O-]

InChI

InChI=1S/C16H17O3S.CH4O3S/c1-20(2)15-10-8-14(9-11-15)19-16(17)18-12-13-6-4-3-5-7-13;1-5(2,3)4/h3-11H,12H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1