[2-ethyl-2-[(4-methylphenyl)sulfonyloxymethyl]butyl] 4-methylbenzenesulfonate

Systemtic Name: [2-ethyl-2-[(4-methylphenyl)sulfonyloxymethyl]butyl] 4-methylbenzenesulfonate Openeye Name: [2-ethyl-2-(p-tolylsulfonyloxymethyl)butyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-ethyl-2-[(4-methylphenyl)sulfonyloxymethyl]butyl] ester IUPAC Name: [2-ethyl-2-[(4-methylphenyl)sulfonyloxymethyl]butyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-ethyl-2-(tosyloxymethyl)butyl] ester Formula: C21H28O6S2 MolecularWeight: 440.57342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(COS(=O)(=O)C1=CC=C(C=C1)C)COS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC(CC)(COS(=O)(=O)C1=CC=C(C=C1)C)COS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H28O6S2/c1-5-21(6-2,15-26-28(22,23)19-11-7-17(3)8-12-19)16-27-29(24,25)20-13-9-18(4)10-14-20/h7-14H,5-6,15-16H2,1-4H3