[1-[(E)-octadec-9-enoxy]-3-(triphenylmethyl)oxy-propan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [1-[(E)-octadec-9-enoxy]-3-(triphenylmethyl)oxy-propan-2-yl] 4-methylbenzenesulfonate Openeye Name: [1-[[(E)-octadec-9-enoxy]methyl]-2-trityloxy-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-[(E)-octadec-9-enoxy]-3-(triphenylmethyl)oxypropan-2-yl] ester IUPAC Name: [1-[(E)-octadec-9-enoxy]-3-trityloxypropan-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [1-[[(E)-octadec-9-enoxy]methyl]-2-trityloxy-ethyl] ester Formula: C47H62O5S MolecularWeight: 739.05718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOCC(COC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOCC(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/C47H62O5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27-38-50-39-45(52-53(48,49)46-36-34-41(2)35-37-46)40-51-47(42-28-21-18-22-29-42,43-30-23-19-24-31-43)44-32-25-20-26-33-44/h10-11,18-26,28-37,45H,3-9,12-17,27,38-40H2,1-2H3/b11-10+