[5-bromanyl-2-(pyridin-3-ylmethoxy)phenyl]methyl-propyl-azanium

Systemtic Name: [5-bromanyl-2-(pyridin-3-ylmethoxy)phenyl]methyl-propyl-azanium Openeye Name: [5-bromo-2-(3-pyridylmethoxy)phenyl]methyl-propyl-ammonium CAS Name: [5-bromo-2-(3-pyridinylmethoxy)phenyl]methyl-propylammonium IUPAC Name: [5-bromo-2-(pyridin-3-ylmethoxy)phenyl]methyl-propylazanium Traditional Name: [5-bromo-2-(3-pyridylmethoxy)benzyl]-propyl-ammonium Formula: C16H20BrN2O+ MolecularWeight: 336.2468

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC1=C(C=CC(=C1)Br)OCC2=CN=CC=C2

Isomeric SMILES

CCC[NH2+]CC1=C(C=CC(=C1)Br)OCC2=CN=CC=C2

InChI

InChI=1S/C16H19BrN2O/c1-2-7-18-11-14-9-15(17)5-6-16(14)20-12-13-4-3-8-19-10-13/h3-6,8-10,18H,2,7,11-12H2,1H3/p+1