[(1S)-1-[3-(4-azanylpyridin-1-ium-3-yl)phenyl]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-[3-(4-azanylpyridin-1-ium-3-yl)phenyl]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-[3-(4-aminopyridin-1-ium-3-yl)phenyl]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-[3-(4-amino-3-pyridin-1-iumyl)phenyl]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-[3-(4-aminopyridin-1-ium-3-yl)phenyl]ethyl]-dimethylazanium Traditional Name: [(1S)-1-[3-(4-aminopyridin-1-ium-3-yl)phenyl]ethyl]-dimethyl-ammonium Formula: C15H21N3+2 MolecularWeight: 243.34734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C2=C(C=C[NH+]=C2)N)[NH+](C)C

Isomeric SMILES

C[C@@H](C1=CC=CC(=C1)C2=C(C=C[NH+]=C2)N)[NH+](C)C

InChI

InChI=1S/C15H19N3/c1-11(18(2)3)12-5-4-6-13(9-12)14-10-17-8-7-15(14)16/h4-11H,1-3H3,(H2,16,17)/p+2/t11-/m0/s1