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

Systemtic Name: [4-[3-[4-(3-ethyl-2-methyl-3-oxidanyl-pentoxy)-3-methyl-phenyl]pentan-3-yl]phenyl] methanesulfonate Openeye Name: [4-[1-ethyl-1-[4-(3-ethyl-3-hydroxy-2-methyl-pentoxy)-3-methyl-phenyl]propyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[3-[4-(3-ethyl-3-hydroxy-2-methylpentoxy)-3-methylphenyl]pentan-3-yl]phenyl] ester IUPAC Name: [4-[3-[4-(3-ethyl-3-hydroxy-2-methylpentoxy)-3-methylphenyl]pentan-3-yl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[1-ethyl-1-[4-(3-ethyl-3-hydroxy-2-methyl-pentoxy)-3-methyl-phenyl]propyl]phenyl] ester Formula: C27H40O5S MolecularWeight: 476.6685

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H40O5S/c1-8-26(9-2,22-12-15-24(16-13-22)32-33(7,29)30)23-14-17-25(20(5)18-23)31-19-21(6)27(28,10-3)11-4/h12-18,21,28H,8-11,19H2,1-7H3