[1-hexadecoxy-3-(4-methylphenyl)sulfonyloxy-propan-2-yl] benzoate

Systemtic Name: [1-hexadecoxy-3-(4-methylphenyl)sulfonyloxy-propan-2-yl] benzoate Openeye Name: [1-(hexadecoxymethyl)-2-(p-tolylsulfonyloxy)ethyl] benzoate CAS Name: benzoic acid [1-hexadecoxy-3-(4-methylphenyl)sulfonyloxypropan-2-yl] ester IUPAC Name: [1-hexadecoxy-3-(4-methylphenyl)sulfonyloxypropan-2-yl] benzoate Traditional Name: benzoic acid [1-(cetyloxymethyl)-2-tosyloxy-ethyl] ester Formula: C33H50O6S MolecularWeight: 574.8115

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COS(=O)(=O)C1=CC=C(C=C1)C)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COS(=O)(=O)C1=CC=C(C=C1)C)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C33H50O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-26-37-27-31(39-33(34)30-20-17-16-18-21-30)28-38-40(35,36)32-24-22-29(2)23-25-32/h16-18,20-25,31H,3-15,19,26-28H2,1-2H3