[3-[methyl(2-methylpropoxy)phosphoryl]-2-oxidanyl-propyl] 4-methylbenzenesulfonate

Systemtic Name: [3-[methyl(2-methylpropoxy)phosphoryl]-2-oxidanyl-propyl] 4-methylbenzenesulfonate Openeye Name: [2-hydroxy-3-[isobutoxy(methyl)phosphoryl]propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-hydroxy-3-[methyl(2-methylpropoxy)phosphoryl]propyl] ester IUPAC Name: [2-hydroxy-3-[methyl(2-methylpropoxy)phosphoryl]propyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-hydroxy-3-[isobutoxy(methyl)phosphoryl]propyl] ester Formula: C15H25O6PS MolecularWeight: 364.394161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(CP(=O)(C)OCC(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(CP(=O)(C)OCC(C)C)O

InChI

InChI=1S/C15H25O6PS/c1-12(2)9-20-22(4,17)11-14(16)10-21-23(18,19)15-7-5-13(3)6-8-15/h5-8,12,14,16H,9-11H2,1-4H3