[(2R)-12-(1-ethoxyethoxy)-2-oxidanyl-dodecyl] 4-methylbenzenesulfonate

Systemtic Name: [(2R)-12-(1-ethoxyethoxy)-2-oxidanyl-dodecyl] 4-methylbenzenesulfonate Openeye Name: [(2R)-12-(1-ethoxyethoxy)-2-hydroxy-dodecyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R)-12-(1-ethoxyethoxy)-2-hydroxydodecyl] ester IUPAC Name: [(2R)-12-(1-ethoxyethoxy)-2-hydroxydodecyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R)-12-(1-ethoxyethoxy)-2-hydroxy-dodecyl] ester Formula: C23H40O6S MolecularWeight: 444.6251

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)OCCCCCCCCCCC(COS(=O)(=O)C1=CC=C(C=C1)C)O

Isomeric SMILES

CCOC(C)OCCCCCCCCCC[C@H](COS(=O)(=O)C1=CC=C(C=C1)C)O

InChI

InChI=1S/C23H40O6S/c1-4-27-21(3)28-18-12-10-8-6-5-7-9-11-13-22(24)19-29-30(25,26)23-16-14-20(2)15-17-23/h14-17,21-22,24H,4-13,18-19H2,1-3H3/t21?,22-/m1/s1