(2R)-2-bromanyl-3-(3-methylpyridin-1-ium-1-yl)propanoate

Systemtic Name: (2R)-2-bromanyl-3-(3-methylpyridin-1-ium-1-yl)propanoate Openeye Name: (2R)-2-bromo-3-(3-methylpyridin-1-ium-1-yl)propanoate CAS Name: (2R)-2-bromo-3-(3-methyl-1-pyridin-1-iumyl)propanoate IUPAC Name: (2R)-2-bromo-3-(3-methylpyridin-1-ium-1-yl)propanoate Traditional Name: (2R)-2-bromo-3-(3-methylpyridin-1-ium-1-yl)propionate Formula: C9H10BrNO2 MolecularWeight: 244.0852

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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)C[C@H](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/t8-/m1/s1