[2-(5-methyl-2-prop-1-en-2-yl-phenyl)-3-methylsulfonyloxy-5-pentyl-phenyl] methanesulfonate

Systemtic Name: [2-(5-methyl-2-prop-1-en-2-yl-phenyl)-3-methylsulfonyloxy-5-pentyl-phenyl] methanesulfonate Openeye Name: [2-(2-isopropenyl-5-methyl-phenyl)-3-methylsulfonyloxy-5-pentyl-phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-[5-methyl-2-(1-methylethenyl)phenyl]-3-methylsulfonyloxy-5-pentylphenyl] ester IUPAC Name: [2-(5-methyl-2-prop-1-en-2-ylphenyl)-3-methylsulfonyloxy-5-pentylphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-amyl-2-(2-isopropenyl-5-methyl-phenyl)-3-methylsulfonyloxy-phenyl] ester Formula: C23H30O6S2 MolecularWeight: 466.6107

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C(=C1)OS(=O)(=O)C)C2=C(C=CC(=C2)C)C(=C)C)OS(=O)(=O)C

Isomeric SMILES

CCCCCC1=CC(=C(C(=C1)OS(=O)(=O)C)C2=C(C=CC(=C2)C)C(=C)C)OS(=O)(=O)C

InChI

InChI=1S/C23H30O6S2/c1-7-8-9-10-18-14-21(28-30(5,24)25)23(22(15-18)29-31(6,26)27)20-13-17(4)11-12-19(20)16(2)3/h11-15H,2,7-10H2,1,3-6H3