2-bromanyl-5-[1-oxidanyl-2-(4-phenylbutan-2-ylamino)ethyl]benzenesulfonamide

Systemtic Name: 2-bromanyl-5-[1-oxidanyl-2-(4-phenylbutan-2-ylamino)ethyl]benzenesulfonamide Openeye Name: 2-bromo-5-[1-hydroxy-2-[(1-methyl-3-phenyl-propyl)amino]ethyl]benzenesulfonamide CAS Name: 2-bromo-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzenesulfonamide IUPAC Name: 2-bromo-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzenesulfonamide Traditional Name: 2-bromo-5-[1-hydroxy-2-[(1-methyl-3-phenyl-propyl)amino]ethyl]benzenesulfonamide Formula: C18H23BrN2O3S MolecularWeight: 427.35582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NCC(C2=CC(=C(C=C2)Br)S(=O)(=O)N)O

Isomeric SMILES

CC(CCC1=CC=CC=C1)NCC(C2=CC(=C(C=C2)Br)S(=O)(=O)N)O

InChI

InChI=1S/C18H23BrN2O3S/c1-13(7-8-14-5-3-2-4-6-14)21-12-17(22)15-9-10-16(19)18(11-15)25(20,23)24/h2-6,9-11,13,17,21-22H,7-8,12H2,1H3,(H2,20,23,24)