2-[4-bromanyl-2-[[3-(methylamino)propylamino]methyl]phenoxy]-N-tert-butyl-ethanamide

Systemtic Name: 2-[4-bromanyl-2-[[3-(methylamino)propylamino]methyl]phenoxy]-N-tert-butyl-ethanamide Openeye Name: 2-[4-bromo-2-[[3-(methylamino)propylamino]methyl]phenoxy]-N-tert-butyl-acetamide CAS Name: 2-[4-bromo-2-[[3-(methylamino)propylamino]methyl]phenoxy]-N-tert-butylacetamide IUPAC Name: 2-[4-bromo-2-[[3-(methylamino)propylamino]methyl]phenoxy]-N-tert-butylacetamide Traditional Name: 2-[4-bromo-2-[[3-(methylamino)propylamino]methyl]phenoxy]-N-tert-butyl-acetamide Formula: C17H28BrN3O2 MolecularWeight: 386.32712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)Br)CNCCCNC

Isomeric SMILES

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)Br)CNCCCNC

InChI

InChI=1S/C17H28BrN3O2/c1-17(2,3)21-16(22)12-23-15-7-6-14(18)10-13(15)11-20-9-5-8-19-4/h6-7,10,19-20H,5,8-9,11-12H2,1-4H3,(H,21,22)