N-[(1R,2R)-1-(4-bromophenyl)-2-diethoxyphosphoryl-2-oxidanyl-ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1R,2R)-1-(4-bromophenyl)-2-diethoxyphosphoryl-2-oxidanyl-ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R,2R)-1-(4-bromophenyl)-2-diethoxyphosphoryl-2-hydroxy-ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1R,2R)-1-(4-bromophenyl)-2-diethoxyphosphoryl-2-hydroxyethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1R,2R)-1-(4-bromophenyl)-2-diethoxyphosphoryl-2-hydroxyethyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R,2R)-1-(4-bromophenyl)-2-diethoxyphosphoryl-2-hydroxy-ethyl]-4-methyl-benzenesulfonamide Formula: C19H25BrNO6PS MolecularWeight: 506.347661

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C(C1=CC=C(C=C1)Br)NS(=O)(=O)C2=CC=C(C=C2)C)O)OCC

Isomeric SMILES

CCOP(=O)([C@H]([C@@H](C1=CC=C(C=C1)Br)NS(=O)(=O)C2=CC=C(C=C2)C)O)OCC

InChI

InChI=1S/C19H25BrNO6PS/c1-4-26-28(23,27-5-2)19(22)18(15-8-10-16(20)11-9-15)21-29(24,25)17-12-6-14(3)7-13-17/h6-13,18-19,21-22H,4-5H2,1-3H3/t18-,19-/m1/s1