4-bromanyl-N-[(2S)-3-(4-tert-butylphenoxy)-2-oxidanyl-propyl]-N-methyl-benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[(2S)-3-(4-tert-butylphenoxy)-2-oxidanyl-propyl]-N-methyl-benzenesulfonamide Openeye Name: 4-bromo-N-[(2S)-3-(4-tert-butylphenoxy)-2-hydroxy-propyl]-N-methyl-benzenesulfonamide CAS Name: 4-bromo-N-[(2S)-3-(4-tert-butylphenoxy)-2-hydroxypropyl]-N-methylbenzenesulfonamide IUPAC Name: 4-bromo-N-[(2S)-3-(4-tert-butylphenoxy)-2-hydroxypropyl]-N-methylbenzenesulfonamide Traditional Name: 4-bromo-N-[(2S)-3-(4-tert-butylphenoxy)-2-hydroxy-propyl]-N-methyl-benzenesulfonamide Formula: C20H26BrNO4S MolecularWeight: 456.39374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26BrNO4S/c1-20(2,3)15-5-9-18(10-6-15)26-14-17(23)13-22(4)27(24,25)19-11-7-16(21)8-12-19/h5-12,17,23H,13-14H2,1-4H3/t17-/m0/s1