6-(4-methylphenyl)sulfonyloxyoct-4-yn-3-yl 4-methylbenzenesulfonate

Systemtic Name: 6-(4-methylphenyl)sulfonyloxyoct-4-yn-3-yl 4-methylbenzenesulfonate Openeye Name: [1-ethyl-4-(p-tolylsulfonyloxy)hex-2-ynyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 6-(4-methylphenyl)sulfonyloxyoct-4-yn-3-yl ester IUPAC Name: 6-(4-methylphenyl)sulfonyloxyoct-4-yn-3-yl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-ethyl-4-tosyloxy-hex-2-ynyl) ester Formula: C22H26O6S2 MolecularWeight: 450.56824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC(CC)OS(=O)(=O)C1=CC=C(C=C1)C)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC(C#CC(CC)OS(=O)(=O)C1=CC=C(C=C1)C)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H26O6S2/c1-5-19(27-29(23,24)21-13-7-17(3)8-14-21)11-12-20(6-2)28-30(25,26)22-15-9-18(4)10-16-22/h7-10,13-16,19-20H,5-6H2,1-4H3