[diethoxyphosphoryl(phenyl)methyl] 4-methylbenzenesulfonate

Systemtic Name: [diethoxyphosphoryl(phenyl)methyl] 4-methylbenzenesulfonate Openeye Name: [diethoxyphosphoryl(phenyl)methyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [diethoxyphosphoryl(phenyl)methyl] ester IUPAC Name: [diethoxyphosphoryl(phenyl)methyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [diethoxyphosphoryl(phenyl)methyl] ester Formula: C18H23O6PS MolecularWeight: 398.410381

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23O6PS/c1-4-22-25(19,23-5-2)18(16-9-7-6-8-10-16)24-26(20,21)17-13-11-15(3)12-14-17/h6-14,18H,4-5H2,1-3H3