[3-(3-octadecoxypropylsulfonyl)-2-phenylmethoxy-propyl] methanesulfonate

Systemtic Name: [3-(3-octadecoxypropylsulfonyl)-2-phenylmethoxy-propyl] methanesulfonate Openeye Name: [2-benzyloxy-3-(3-octadecoxypropylsulfonyl)propyl] methanesulfonate CAS Name: methanesulfonic acid [3-(3-octadecoxypropylsulfonyl)-2-phenylmethoxypropyl] ester IUPAC Name: [3-(3-octadecoxypropylsulfonyl)-2-phenylmethoxypropyl] methanesulfonate Traditional Name: methanesulfonic acid [2-benzoxy-3-(3-stearyloxypropylsulfonyl)propyl] ester Formula: C32H58O7S2 MolecularWeight: 618.92872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCCS(=O)(=O)CC(COS(=O)(=O)C)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCCS(=O)(=O)CC(COS(=O)(=O)C)OCC1=CC=CC=C1

InChI

InChI=1S/C32H58O7S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25-37-26-22-27-41(35,36)30-32(29-39-40(2,33)34)38-28-31-23-19-18-20-24-31/h18-20,23-24,32H,3-17,21-22,25-30H2,1-2H3