N-[[3-bromanyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]propan-1-amine hydrochloride

Systemtic Name: N-[[3-bromanyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]propan-1-amine hydrochloride Openeye Name: N-[[3-bromo-5-methoxy-4-(3-pyridylmethoxy)phenyl]methyl]propan-1-amine hydrochloride CAS Name: N-[[3-bromo-5-methoxy-4-(3-pyridinylmethoxy)phenyl]methyl]-1-propanamine hydrochloride IUPAC Name: N-[[3-bromo-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]propan-1-amine hydrochloride Traditional Name: [3-bromo-5-methoxy-4-(3-pyridylmethoxy)benzyl]-propyl-amine hydrochloride Formula: C17H22BrClN2O2 MolecularWeight: 401.72578

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CC(=C(C(=C1)Br)OCC2=CN=CC=C2)OC.Cl

Isomeric SMILES

CCCNCC1=CC(=C(C(=C1)Br)OCC2=CN=CC=C2)OC.Cl

InChI

InChI=1S/C17H21BrN2O2.ClH/c1-3-6-19-11-14-8-15(18)17(16(9-14)21-2)22-12-13-5-4-7-20-10-13;/h4-5,7-10,19H,3,6,11-12H2,1-2H3;1H