N-[[5-bromanyl-2-(pyridin-3-ylmethoxy)phenyl]methyl]butan-1-amine hydrochloride

Systemtic Name: N-[[5-bromanyl-2-(pyridin-3-ylmethoxy)phenyl]methyl]butan-1-amine hydrochloride Openeye Name: N-[[5-bromo-2-(3-pyridylmethoxy)phenyl]methyl]butan-1-amine hydrochloride CAS Name: N-[[5-bromo-2-(3-pyridinylmethoxy)phenyl]methyl]-1-butanamine hydrochloride IUPAC Name: N-[[5-bromo-2-(pyridin-3-ylmethoxy)phenyl]methyl]butan-1-amine hydrochloride Traditional Name: [5-bromo-2-(3-pyridylmethoxy)benzyl]-butyl-amine hydrochloride Formula: C17H22BrClN2O MolecularWeight: 385.72638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=C(C=CC(=C1)Br)OCC2=CN=CC=C2.Cl

Isomeric SMILES

CCCCNCC1=C(C=CC(=C1)Br)OCC2=CN=CC=C2.Cl

InChI

InChI=1S/C17H21BrN2O.ClH/c1-2-3-8-20-12-15-10-16(18)6-7-17(15)21-13-14-5-4-9-19-11-14;/h4-7,9-11,20H,2-3,8,12-13H2,1H3;1H