(2,6,10,14-tetramethyl-3-oxidanyl-pentadecyl) 4-methylbenzenesulfonate

Systemtic Name: (2,6,10,14-tetramethyl-3-oxidanyl-pentadecyl) 4-methylbenzenesulfonate Openeye Name: (3-hydroxy-2,6,10,14-tetramethyl-pentadecyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (3-hydroxy-2,6,10,14-tetramethylpentadecyl) ester IUPAC Name: (3-hydroxy-2,6,10,14-tetramethylpentadecyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3-hydroxy-2,6,10,14-tetramethyl-pentadecyl) ester Formula: C26H46O4S MolecularWeight: 454.70604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)C(CCC(C)CCCC(C)CCCC(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)C(CCC(C)CCCC(C)CCCC(C)C)O

InChI

InChI=1S/C26H46O4S/c1-20(2)9-7-10-21(3)11-8-12-22(4)15-18-26(27)24(6)19-30-31(28,29)25-16-13-23(5)14-17-25/h13-14,16-17,20-22,24,26-27H,7-12,15,18-19H2,1-6H3