[(S)-(4-acetamidophenyl)-(5-bromanylpyridin-3-yl)methyl]azanium

Systemtic Name: [(S)-(4-acetamidophenyl)-(5-bromanylpyridin-3-yl)methyl]azanium Openeye Name: [(S)-(4-acetamidophenyl)-(5-bromo-3-pyridyl)methyl]ammonium CAS Name: [(S)-(4-acetamidophenyl)-(5-bromo-3-pyridinyl)methyl]ammonium IUPAC Name: [(S)-(4-acetamidophenyl)-(5-bromopyridin-3-yl)methyl]azanium Traditional Name: [(S)-(4-acetamidophenyl)-(5-bromo-3-pyridyl)methyl]ammonium Formula: C14H15BrN3O+ MolecularWeight: 321.1924

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(C2=CC(=CN=C2)Br)[NH3+]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)[C@@H](C2=CC(=CN=C2)Br)[NH3+]

InChI

InChI=1S/C14H14BrN3O/c1-9(19)18-13-4-2-10(3-5-13)14(16)11-6-12(15)8-17-7-11/h2-8,14H,16H2,1H3,(H,18,19)/p+1/t14-/m0/s1