[1-[3-(methylsulfonylamino)-4-phenylmethoxy-phenyl]-1-oxidanyl-propan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [1-[3-(methylsulfonylamino)-4-phenylmethoxy-phenyl]-1-oxidanyl-propan-2-yl] 4-methylbenzenesulfonate Openeye Name: [2-[4-benzyloxy-3-(methanesulfonamido)phenyl]-2-hydroxy-1-methyl-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-hydroxy-1-[3-(methanesulfonamido)-4-phenylmethoxyphenyl]propan-2-yl] ester IUPAC Name: [1-hydroxy-1-[3-(methanesulfonamido)-4-phenylmethoxyphenyl]propan-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-[4-benzoxy-3-(methanesulfonamido)phenyl]-2-hydroxy-1-methyl-ethyl] ester Formula: C24H27NO7S2 MolecularWeight: 505.60368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(C2=CC(=C(C=C2)OCC3=CC=CC=C3)NS(=O)(=O)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(C2=CC(=C(C=C2)OCC3=CC=CC=C3)NS(=O)(=O)C)O

InChI

InChI=1S/C24H27NO7S2/c1-17-9-12-21(13-10-17)34(29,30)32-18(2)24(26)20-11-14-23(22(15-20)25-33(3,27)28)31-16-19-7-5-4-6-8-19/h4-15,18,24-26H,16H2,1-3H3