[4-methylsulfonyloxy-3-[3-(2-phenylphenoxy)propylsulfonyl]butyl] methanesulfonate

Systemtic Name: [4-methylsulfonyloxy-3-[3-(2-phenylphenoxy)propylsulfonyl]butyl] methanesulfonate Openeye Name: [4-methylsulfonyloxy-3-[3-(2-phenylphenoxy)propylsulfonyl]butyl] methanesulfonate CAS Name: methanesulfonic acid [4-methylsulfonyloxy-3-[3-(2-phenylphenoxy)propylsulfonyl]butyl] ester IUPAC Name: [4-methylsulfonyloxy-3-[3-(2-phenylphenoxy)propylsulfonyl]butyl] methanesulfonate Traditional Name: methanesulfonic acid [4-methylsulfonyloxy-3-[3-(2-phenylphenoxy)propylsulfonyl]butyl] ester Formula: C21H28O9S3 MolecularWeight: 520.63662

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC(COS(=O)(=O)C)S(=O)(=O)CCCOC1=CC=CC=C1C2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)OCCC(COS(=O)(=O)C)S(=O)(=O)CCCOC1=CC=CC=C1C2=CC=CC=C2

InChI

InChI=1S/C21H28O9S3/c1-31(22,23)29-15-13-19(17-30-32(2,24)25)33(26,27)16-8-14-28-21-12-7-6-11-20(21)18-9-4-3-5-10-18/h3-7,9-12,19H,8,13-17H2,1-2H3