5-bromanyl-N-[(4-dimethylaminophenyl)methyl]pyridin-1-ium-2-amine

Systemtic Name: 5-bromanyl-N-[(4-dimethylaminophenyl)methyl]pyridin-1-ium-2-amine Openeye Name: 5-bromo-N-[(4-dimethylaminophenyl)methyl]pyridin-1-ium-2-amine CAS Name: 5-bromo-N-[(4-dimethylaminophenyl)methyl]-2-pyridin-1-iumamine IUPAC Name: 5-bromo-N-[(4-dimethylaminophenyl)methyl]pyridin-1-ium-2-amine Traditional Name: [4-[[(5-bromopyridin-1-ium-2-yl)amino]methyl]phenyl]-dimethyl-amine Formula: C14H17BrN3+ MolecularWeight: 307.20888

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC2=[NH+]C=C(C=C2)Br

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC2=[NH+]C=C(C=C2)Br

InChI

InChI=1S/C14H16BrN3/c1-18(2)13-6-3-11(4-7-13)9-16-14-8-5-12(15)10-17-14/h3-8,10H,9H2,1-2H3,(H,16,17)/p+1