4-bromanyl-N-[(2S)-3-(4-chloranyl-3-methyl-phenoxy)-2-oxidanyl-propyl]-N-methyl-benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[(2S)-3-(4-chloranyl-3-methyl-phenoxy)-2-oxidanyl-propyl]-N-methyl-benzenesulfonamide Openeye Name: 4-bromo-N-[(2S)-3-(4-chloro-3-methyl-phenoxy)-2-hydroxy-propyl]-N-methyl-benzenesulfonamide CAS Name: 4-bromo-N-[(2S)-3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-N-methylbenzenesulfonamide IUPAC Name: 4-bromo-N-[(2S)-3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl]-N-methylbenzenesulfonamide Traditional Name: 4-bromo-N-[(2S)-3-(4-chloro-3-methyl-phenoxy)-2-hydroxy-propyl]-N-methyl-benzenesulfonamide Formula: C17H19BrClNO4S MolecularWeight: 448.75906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(CN(C)S(=O)(=O)C2=CC=C(C=C2)Br)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC[C@H](CN(C)S(=O)(=O)C2=CC=C(C=C2)Br)O)Cl

InChI

InChI=1S/C17H19BrClNO4S/c1-12-9-15(5-8-17(12)19)24-11-14(21)10-20(2)25(22,23)16-6-3-13(18)4-7-16/h3-9,14,21H,10-11H2,1-2H3/t14-/m0/s1