(6-diethoxyphosphoryl-5-oxidanyl-1-phenylmethoxy-hexan-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (6-diethoxyphosphoryl-5-oxidanyl-1-phenylmethoxy-hexan-2-yl) 4-methylbenzenesulfonate Openeye Name: [1-(benzyloxymethyl)-5-diethoxyphosphoryl-4-hydroxy-pentyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (6-diethoxyphosphoryl-5-hydroxy-1-phenylmethoxyhexan-2-yl) ester IUPAC Name: (6-diethoxyphosphoryl-5-hydroxy-1-phenylmethoxyhexan-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [1-(benzoxymethyl)-5-diethoxyphosphoryl-4-hydroxy-pentyl] ester Formula: C24H35O8PS MolecularWeight: 514.568661

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC(CCC(COCC1=CC=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)C)O)OCC

Isomeric SMILES

CCOP(=O)(CC(CCC(COCC1=CC=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)C)O)OCC

InChI

InChI=1S/C24H35O8PS/c1-4-30-33(26,31-5-2)19-22(25)13-14-23(18-29-17-21-9-7-6-8-10-21)32-34(27,28)24-15-11-20(3)12-16-24/h6-12,15-16,22-23,25H,4-5,13-14,17-19H2,1-3H3