[4-[3-[4-(3-ethyl-2-methyl-3-oxidanyl-pentoxy)-3-methyl-phenyl]pentan-3-yl]-2-methyl-phenyl] methanesulfonate

Systemtic Name: [4-[3-[4-(3-ethyl-2-methyl-3-oxidanyl-pentoxy)-3-methyl-phenyl]pentan-3-yl]-2-methyl-phenyl] methanesulfonate Openeye Name: [4-[1-ethyl-1-[4-(3-ethyl-3-hydroxy-2-methyl-pentoxy)-3-methyl-phenyl]propyl]-2-methyl-phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[3-[4-(3-ethyl-3-hydroxy-2-methylpentoxy)-3-methylphenyl]pentan-3-yl]-2-methylphenyl] ester IUPAC Name: [4-[3-[4-(3-ethyl-3-hydroxy-2-methylpentoxy)-3-methylphenyl]pentan-3-yl]-2-methylphenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[1-ethyl-1-[4-(3-ethyl-3-hydroxy-2-methyl-pentoxy)-3-methyl-phenyl]propyl]-2-methyl-phenyl] ester Formula: C28H42O5S MolecularWeight: 490.69508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H42O5S/c1-9-27(10-2,24-14-16-26(21(6)18-24)33-34(8,30)31)23-13-15-25(20(5)17-23)32-19-22(7)28(29,11-3)12-4/h13-18,22,29H,9-12,19H2,1-8H3