[(1S)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: [(1S)-1-(5-bromanyl-1-benzofuran-2-yl)ethyl]-(pyridin-4-ylmethyl)azanium Openeye Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-(4-pyridylmethyl)ammonium CAS Name: [(1S)-1-(5-bromo-2-benzofuranyl)ethyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: [(1S)-1-(5-bromo-1-benzofuran-2-yl)ethyl]-(pyridin-4-ylmethyl)azanium Traditional Name: [(1S)-1-(5-bromobenzofuran-2-yl)ethyl]-(4-pyridylmethyl)ammonium Formula: C16H16BrN2O+ MolecularWeight: 332.21504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(O1)C=CC(=C2)Br)[NH2+]CC3=CC=NC=C3

Isomeric SMILES

C[C@@H](C1=CC2=C(O1)C=CC(=C2)Br)[NH2+]CC3=CC=NC=C3

InChI

InChI=1S/C16H15BrN2O/c1-11(19-10-12-4-6-18-7-5-12)16-9-13-8-14(17)2-3-15(13)20-16/h2-9,11,19H,10H2,1H3/p+1/t11-/m0/s1