[(E)-3-(methylsulfonyloxymethyl)-4-(4-phenylmethoxyphenyl)but-3-enyl] methanesulfonate

Systemtic Name: [(E)-3-(methylsulfonyloxymethyl)-4-(4-phenylmethoxyphenyl)but-3-enyl] methanesulfonate Openeye Name: [(E)-4-(4-benzyloxyphenyl)-3-(methylsulfonyloxymethyl)but-3-enyl] methanesulfonate CAS Name: methanesulfonic acid [(E)-3-(methylsulfonyloxymethyl)-4-(4-phenylmethoxyphenyl)but-3-enyl] ester IUPAC Name: [(E)-3-(methylsulfonyloxymethyl)-4-(4-phenylmethoxyphenyl)but-3-enyl] methanesulfonate Traditional Name: methanesulfonic acid [(E)-4-(4-benzoxyphenyl)-3-(methylsulfonyloxymethyl)but-3-enyl] ester Formula: C20H24O7S2 MolecularWeight: 440.53036

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC(=CC1=CC=C(C=C1)OCC2=CC=CC=C2)COS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)OCC/C(=C\C1=CC=C(C=C1)OCC2=CC=CC=C2)/COS(=O)(=O)C

InChI

InChI=1S/C20H24O7S2/c1-28(21,22)26-13-12-19(16-27-29(2,23)24)14-17-8-10-20(11-9-17)25-15-18-6-4-3-5-7-18/h3-11,14H,12-13,15-16H2,1-2H3/b19-14+