[4-[[2-bromanyl-4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]phenyl]methanamine

Systemtic Name: [4-[[2-bromanyl-4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]phenyl]methanamine Openeye Name: [4-[[2-bromo-4-(1,1,3,3-tetramethylbutyl)phenoxy]methyl]phenyl]methanamine CAS Name: [4-[[2-bromo-4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]phenyl]methanamine IUPAC Name: [4-[[2-bromo-4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]phenyl]methanamine Traditional Name: [4-[[2-bromo-4-(1,1,3,3-tetramethylbutyl)phenoxy]methyl]benzyl]amine Formula: C22H30BrNO MolecularWeight: 404.3837

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)OCC2=CC=C(C=C2)CN)Br

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)OCC2=CC=C(C=C2)CN)Br

InChI

InChI=1S/C22H30BrNO/c1-21(2,3)15-22(4,5)18-10-11-20(19(23)12-18)25-14-17-8-6-16(13-24)7-9-17/h6-12H,13-15,24H2,1-5H3