2-[4-bromanyl-2-[[2-(2-oxidanylpropylamino)ethylamino]methyl]phenoxy]-N-tert-butyl-ethanamide

Systemtic Name: 2-[4-bromanyl-2-[[2-(2-oxidanylpropylamino)ethylamino]methyl]phenoxy]-N-tert-butyl-ethanamide Openeye Name: 2-[4-bromo-2-[[2-(2-hydroxypropylamino)ethylamino]methyl]phenoxy]-N-tert-butyl-acetamide CAS Name: 2-[4-bromo-2-[[2-(2-hydroxypropylamino)ethylamino]methyl]phenoxy]-N-tert-butylacetamide IUPAC Name: 2-[4-bromo-2-[[2-(2-hydroxypropylamino)ethylamino]methyl]phenoxy]-N-tert-butylacetamide Traditional Name: 2-[4-bromo-2-[[2-(2-hydroxypropylamino)ethylamino]methyl]phenoxy]-N-tert-butyl-acetamide Formula: C18H30BrN3O3 MolecularWeight: 416.3531

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNCCNCC1=C(C=CC(=C1)Br)OCC(=O)NC(C)(C)C)O

Isomeric SMILES

CC(CNCCNCC1=C(C=CC(=C1)Br)OCC(=O)NC(C)(C)C)O

InChI

InChI=1S/C18H30BrN3O3/c1-13(23)10-20-7-8-21-11-14-9-15(19)5-6-16(14)25-12-17(24)22-18(2,3)4/h5-6,9,13,20-21,23H,7-8,10-12H2,1-4H3,(H,22,24)