[4-methyl-5-(4-methylphenyl)sulfonyloxy-pentyl] 4-methylbenzenesulfonate

Systemtic Name: [4-methyl-5-(4-methylphenyl)sulfonyloxy-pentyl] 4-methylbenzenesulfonate Openeye Name: [4-methyl-5-(p-tolylsulfonyloxy)pentyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-methyl-5-(4-methylphenyl)sulfonyloxypentyl] ester IUPAC Name: [4-methyl-5-(4-methylphenyl)sulfonyloxypentyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-methyl-5-tosyloxy-pentyl) ester Formula: C20H26O6S2 MolecularWeight: 426.54684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC(C)COS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC(C)COS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H26O6S2/c1-16-6-10-19(11-7-16)27(21,22)25-14-4-5-18(3)15-26-28(23,24)20-12-8-17(2)9-13-20/h6-13,18H,4-5,14-15H2,1-3H3