[(1S)-1-(3-bromophenyl)-3-[2-(2-oxidanylpropan-2-yl)phenyl]propyl] methanesulfonate

Systemtic Name: [(1S)-1-(3-bromophenyl)-3-[2-(2-oxidanylpropan-2-yl)phenyl]propyl] methanesulfonate Openeye Name: [(1S)-1-(3-bromophenyl)-3-[2-(1-hydroxy-1-methyl-ethyl)phenyl]propyl] methanesulfonate CAS Name: methanesulfonic acid [(1S)-1-(3-bromophenyl)-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl] ester IUPAC Name: [(1S)-1-(3-bromophenyl)-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl] methanesulfonate Traditional Name: methanesulfonic acid [(1S)-1-(3-bromophenyl)-3-[2-(1-hydroxy-1-methyl-ethyl)phenyl]propyl] ester Formula: C19H23BrO4S MolecularWeight: 427.35252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1CCC(C2=CC(=CC=C2)Br)OS(=O)(=O)C)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1CC[C@@H](C2=CC(=CC=C2)Br)OS(=O)(=O)C)O

InChI

InChI=1S/C19H23BrO4S/c1-19(2,21)17-10-5-4-7-14(17)11-12-18(24-25(3,22)23)15-8-6-9-16(20)13-15/h4-10,13,18,21H,11-12H2,1-3H3/t18-/m0/s1