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

Systemtic Name: [(S)-(5-bromanylpyridin-3-yl)-(4-methylphenyl)methyl]azanium Openeye Name: [(S)-(5-bromo-3-pyridyl)-(p-tolyl)methyl]ammonium CAS Name: [(S)-(5-bromo-3-pyridinyl)-(4-methylphenyl)methyl]ammonium IUPAC Name: [(S)-(5-bromopyridin-3-yl)-(4-methylphenyl)methyl]azanium Traditional Name: [(S)-(5-bromo-3-pyridyl)-(p-tolyl)methyl]ammonium Formula: C13H14BrN2+ MolecularWeight: 278.16766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC(=CN=C2)Br)[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2=CC(=CN=C2)Br)[NH3+]

InChI

InChI=1S/C13H13BrN2/c1-9-2-4-10(5-3-9)13(15)11-6-12(14)8-16-7-11/h2-8,13H,15H2,1H3/p+1/t13-/m0/s1