[3-(4-butan-2-ylphenyl)-4-methylsulfonyloxy-butyl] methanesulfonate

Systemtic Name: [3-(4-butan-2-ylphenyl)-4-methylsulfonyloxy-butyl] methanesulfonate Openeye Name: [4-methylsulfonyloxy-3-(4-sec-butylphenyl)butyl] methanesulfonate CAS Name: methanesulfonic acid [3-(4-butan-2-ylphenyl)-4-methylsulfonyloxybutyl] ester IUPAC Name: [3-(4-butan-2-ylphenyl)-4-methylsulfonyloxybutyl] methanesulfonate Traditional Name: methanesulfonic acid [4-methylsulfonyloxy-3-(4-sec-butylphenyl)butyl] ester Formula: C16H26O6S2 MolecularWeight: 378.50404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26O6S2/c1-5-13(2)14-6-8-15(9-7-14)16(12-22-24(4,19)20)10-11-21-23(3,17)18/h6-9,13,16H,5,10-12H2,1-4H3