[1-(4-methoxyphenyl)-4-phenyl-1-(phenylsulfinyl)butan-2-yl] methanesulfonate

Systemtic Name: [1-(4-methoxyphenyl)-4-phenyl-1-(phenylsulfinyl)butan-2-yl] methanesulfonate Openeye Name: [1-[benzenesulfinyl-(4-methoxyphenyl)methyl]-3-phenyl-propyl] methanesulfonate CAS Name: methanesulfonic acid [1-(benzenesulfinyl)-1-(4-methoxyphenyl)-4-phenylbutan-2-yl] ester IUPAC Name: [1-(benzenesulfinyl)-1-(4-methoxyphenyl)-4-phenylbutan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-[benzenesulfinyl-(4-methoxyphenyl)methyl]-3-phenyl-propyl] ester Formula: C24H26O5S2 MolecularWeight: 458.59024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(CCC2=CC=CC=C2)OS(=O)(=O)C)S(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(C(CCC2=CC=CC=C2)OS(=O)(=O)C)S(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H26O5S2/c1-28-21-16-14-20(15-17-21)24(30(25)22-11-7-4-8-12-22)23(29-31(2,26)27)18-13-19-9-5-3-6-10-19/h3-12,14-17,23-24H,13,18H2,1-2H3