[1-[(E)-hexadec-8-enoxy]-3-(triphenylmethyl)oxy-propan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [1-[(E)-hexadec-8-enoxy]-3-(triphenylmethyl)oxy-propan-2-yl] 4-methylbenzenesulfonate Openeye Name: [1-[[(E)-hexadec-8-enoxy]methyl]-2-trityloxy-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-[(E)-hexadec-8-enoxy]-3-(triphenylmethyl)oxypropan-2-yl] ester IUPAC Name: [1-[(E)-hexadec-8-enoxy]-3-trityloxypropan-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [1-[[(E)-hexadec-8-enoxy]methyl]-2-trityloxy-ethyl] ester Formula: C45H58O5S MolecularWeight: 711.00402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=CCCCCCCCOCC(COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCCCC/C=C/CCCCCCCOCC(COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C45H58O5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-25-36-48-37-43(50-51(46,47)44-34-32-39(2)33-35-44)38-49-45(40-26-19-16-20-27-40,41-28-21-17-22-29-41)42-30-23-18-24-31-42/h9-10,16-24,26-35,43H,3-8,11-15,25,36-38H2,1-2H3/b10-9+