1-(4-methylphenyl)sulfonyl-2-[(2-octadecylphenyl)methyl]propane-1,2,3-triol

Systemtic Name: 1-(4-methylphenyl)sulfonyl-2-[(2-octadecylphenyl)methyl]propane-1,2,3-triol Openeye Name: 2-[(2-octadecylphenyl)methyl]-1-(p-tolylsulfonyl)propane-1,2,3-triol CAS Name: 1-(4-methylphenyl)sulfonyl-2-[(2-octadecylphenyl)methyl]propane-1,2,3-triol IUPAC Name: 1-(4-methylphenyl)sulfonyl-2-[(2-octadecylphenyl)methyl]propane-1,2,3-triol Traditional Name: 2-(2-stearylbenzyl)-1-tosyl-propane-1,2,3-triol Formula: C35H56O5S MolecularWeight: 588.88114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC=CC=C1CC(CO)(C(O)S(=O)(=O)C2=CC=C(C=C2)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC=CC=C1CC(CO)(C(O)S(=O)(=O)C2=CC=C(C=C2)C)O

InChI

InChI=1S/C35H56O5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-31-22-19-20-23-32(31)28-35(38,29-36)34(37)41(39,40)33-26-24-30(2)25-27-33/h19-20,22-27,34,36-38H,3-18,21,28-29H2,1-2H3