ethyl 2-(2-azanyl-5-bromanyl-pyridin-1-ium-1-yl)ethanoate bromide

Systemtic Name: ethyl 2-(2-azanyl-5-bromanyl-pyridin-1-ium-1-yl)ethanoate bromide Openeye Name: ethyl 2-(2-amino-5-bromo-pyridin-1-ium-1-yl)acetate bromide CAS Name: 2-(2-amino-5-bromo-1-pyridin-1-iumyl)acetic acid ethyl ester bromide IUPAC Name: ethyl 2-(2-amino-5-bromopyridin-1-ium-1-yl)acetate bromide Traditional Name: 2-(2-amino-5-bromo-pyridin-1-ium-1-yl)acetic acid ethyl ester bromide Formula: C9H12Br2N2O2 MolecularWeight: 340.01178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=C(C=CC(=C1)Br)N.[Br-]

Isomeric SMILES

CCOC(=O)C[N+]1=C(C=CC(=C1)Br)N.[Br-]

InChI

InChI=1S/C9H11BrN2O2.BrH/c1-2-14-9(13)6-12-5-7(10)3-4-8(12)11;/h3-5,11H,2,6H2,1H3;1H