[(1S,2R,3S)-1-(4-methoxyphenyl)-2-methyl-3-(methylsulfonylamino)-3-phenyl-propyl] methanesulfonate

Systemtic Name: [(1S,2R,3S)-1-(4-methoxyphenyl)-2-methyl-3-(methylsulfonylamino)-3-phenyl-propyl] methanesulfonate Openeye Name: [(1S,2R,3S)-3-(methanesulfonamido)-1-(4-methoxyphenyl)-2-methyl-3-phenyl-propyl] methanesulfonate CAS Name: methanesulfonic acid [(1S,2R,3S)-3-(methanesulfonamido)-1-(4-methoxyphenyl)-2-methyl-3-phenylpropyl] ester IUPAC Name: [(1S,2R,3S)-3-(methanesulfonamido)-1-(4-methoxyphenyl)-2-methyl-3-phenylpropyl] methanesulfonate Traditional Name: methanesulfonic acid [(1S,2R,3S)-3-(methanesulfonamido)-1-(4-methoxyphenyl)-2-methyl-3-phenyl-propyl] ester Formula: C19H25NO6S2 MolecularWeight: 427.5349

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)NS(=O)(=O)C)C(C2=CC=C(C=C2)OC)OS(=O)(=O)C

Isomeric SMILES

C[C@H]([C@@H](C1=CC=CC=C1)NS(=O)(=O)C)[C@@H](C2=CC=C(C=C2)OC)OS(=O)(=O)C

InChI

InChI=1S/C19H25NO6S2/c1-14(18(20-27(3,21)22)15-8-6-5-7-9-15)19(26-28(4,23)24)16-10-12-17(25-2)13-11-16/h5-14,18-20H,1-4H3/t14-,18+,19+/m1/s1