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

Systemtic Name: [4-[3-[4-(4-ethyl-2-methyl-4-oxidanyl-hexyl)phenyl]pentan-3-yl]-2-methyl-phenyl] methanesulfonate Openeye Name: [4-[1-ethyl-1-[4-(4-ethyl-4-hydroxy-2-methyl-hexyl)phenyl]propyl]-2-methyl-phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[3-[4-(4-ethyl-4-hydroxy-2-methylhexyl)phenyl]pentan-3-yl]-2-methylphenyl] ester IUPAC Name: [4-[3-[4-(4-ethyl-4-hydroxy-2-methylhexyl)phenyl]pentan-3-yl]-2-methylphenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[1-ethyl-1-[4-(4-ethyl-4-hydroxy-2-methyl-hexyl)phenyl]propyl]-2-methyl-phenyl] ester Formula: C28H42O4S MolecularWeight: 474.69568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H42O4S/c1-8-27(29,9-2)20-21(5)18-23-12-14-24(15-13-23)28(10-3,11-4)25-16-17-26(22(6)19-25)32-33(7,30)31/h12-17,19,21,29H,8-11,18,20H2,1-7H3