N-[[5-bromanyl-2-(2-methylpropoxy)phenyl]methyl]ethanamine

Systemtic Name: N-[[5-bromanyl-2-(2-methylpropoxy)phenyl]methyl]ethanamine Openeye Name: N-[(5-bromo-2-isobutoxy-phenyl)methyl]ethanamine CAS Name: N-[[5-bromo-2-(2-methylpropoxy)phenyl]methyl]ethanamine IUPAC Name: N-[[5-bromo-2-(2-methylpropoxy)phenyl]methyl]ethanamine Traditional Name: (5-bromo-2-isobutoxy-benzyl)-ethyl-amine Formula: C13H20BrNO MolecularWeight: 286.208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=C(C=CC(=C1)Br)OCC(C)C

Isomeric SMILES

CCNCC1=C(C=CC(=C1)Br)OCC(C)C

InChI

InChI=1S/C13H20BrNO/c1-4-15-8-11-7-12(14)5-6-13(11)16-9-10(2)3/h5-7,10,15H,4,8-9H2,1-3H3