4-bromanyl-N-[1-(4-dimethylaminophenyl)-3-methyl-1-oxidanyl-pentan-2-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[1-(4-dimethylaminophenyl)-3-methyl-1-oxidanyl-pentan-2-yl]benzenesulfonamide Openeye Name: 4-bromo-N-[1-[(4-dimethylaminophenyl)-hydroxy-methyl]-2-methyl-butyl]benzenesulfonamide CAS Name: 4-bromo-N-[1-(4-dimethylaminophenyl)-1-hydroxy-3-methylpentan-2-yl]benzenesulfonamide IUPAC Name: 4-bromo-N-[1-(4-dimethylaminophenyl)-1-hydroxy-3-methylpentan-2-yl]benzenesulfonamide Traditional Name: 4-bromo-N-[1-[(4-dimethylaminophenyl)-hydroxy-methyl]-2-methyl-butyl]benzenesulfonamide Formula: C20H27BrN2O3S MolecularWeight: 455.40898

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C1=CC=C(C=C1)N(C)C)O)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCC(C)C(C(C1=CC=C(C=C1)N(C)C)O)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H27BrN2O3S/c1-5-14(2)19(20(24)15-6-10-17(11-7-15)23(3)4)22-27(25,26)18-12-8-16(21)9-13-18/h6-14,19-20,22,24H,5H2,1-4H3