N-[[5-bromanyl-2-(pyridin-3-ylmethoxy)phenyl]methyl]cyclopropanamine

Systemtic Name: N-[[5-bromanyl-2-(pyridin-3-ylmethoxy)phenyl]methyl]cyclopropanamine Openeye Name: N-[[5-bromo-2-(3-pyridylmethoxy)phenyl]methyl]cyclopropanamine CAS Name: N-[[5-bromo-2-(3-pyridinylmethoxy)phenyl]methyl]cyclopropanamine IUPAC Name: N-[[5-bromo-2-(pyridin-3-ylmethoxy)phenyl]methyl]cyclopropanamine Traditional Name: [5-bromo-2-(3-pyridylmethoxy)benzyl]-cyclopropyl-amine Formula: C16H17BrN2O MolecularWeight: 333.22298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NCC2=C(C=CC(=C2)Br)OCC3=CN=CC=C3

Isomeric SMILES

C1CC1NCC2=C(C=CC(=C2)Br)OCC3=CN=CC=C3

InChI

InChI=1S/C16H17BrN2O/c17-14-3-6-16(13(8-14)10-19-15-4-5-15)20-11-12-2-1-7-18-9-12/h1-3,6-9,15,19H,4-5,10-11H2