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

Systemtic Name: [4-[3-[4-(4-ethyl-2-methyl-4-oxidanyl-hexyl)-3-methyl-phenyl]pentan-3-yl]-2-methyl-phenyl] methanesulfonate Openeye Name: [4-[1-ethyl-1-[4-(4-ethyl-4-hydroxy-2-methyl-hexyl)-3-methyl-phenyl]propyl]-2-methyl-phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[3-[4-(4-ethyl-4-hydroxy-2-methylhexyl)-3-methylphenyl]pentan-3-yl]-2-methylphenyl] ester IUPAC Name: [4-[3-[4-(4-ethyl-4-hydroxy-2-methylhexyl)-3-methylphenyl]pentan-3-yl]-2-methylphenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[1-ethyl-1-[4-(4-ethyl-4-hydroxy-2-methyl-hexyl)-3-methyl-phenyl]propyl]-2-methyl-phenyl] ester Formula: C29H44O4S MolecularWeight: 488.72226

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(C)CC1=C(C=C(C=C1)C(CC)(CC)C2=CC(=C(C=C2)OS(=O)(=O)C)C)C)O

Isomeric SMILES

CCC(CC)(CC(C)CC1=C(C=C(C=C1)C(CC)(CC)C2=CC(=C(C=C2)OS(=O)(=O)C)C)C)O

InChI

InChI=1S/C29H44O4S/c1-9-28(30,10-2)20-21(5)17-24-13-14-25(18-22(24)6)29(11-3,12-4)26-15-16-27(23(7)19-26)33-34(8,31)32/h13-16,18-19,21,30H,9-12,17,20H2,1-8H3