2-bromanyl-3-(3-methylpyridin-1-ium-1-yl)propanoic acid

Systemtic Name: 2-bromanyl-3-(3-methylpyridin-1-ium-1-yl)propanoic acid Openeye Name: 2-bromo-3-(3-methylpyridin-1-ium-1-yl)propanoic acid CAS Name: 2-bromo-3-(3-methyl-1-pyridin-1-iumyl)propanoic acid IUPAC Name: 2-bromo-3-(3-methylpyridin-1-ium-1-yl)propanoic acid Traditional Name: 2-bromo-3-(3-methylpyridin-1-ium-1-yl)propionic acid Formula: C9H11BrNO2+ MolecularWeight: 245.09314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)CC(C(=O)O)Br

Isomeric SMILES

CC1=C[N+](=CC=C1)CC(C(=O)O)Br

InChI

InChI=1S/C9H10BrNO2/c1-7-3-2-4-11(5-7)6-8(10)9(12)13/h2-5,8H,6H2,1H3/p+1