2-[(2-bromanyl-6-chloranyl-1,1-dimethyl-2H-pyridin-1-ium-5-yl)oxy]ethanoic acid

Systemtic Name: 2-[(2-bromanyl-6-chloranyl-1,1-dimethyl-2H-pyridin-1-ium-5-yl)oxy]ethanoic acid Openeye Name: 2-[(2-bromo-6-chloro-1,1-dimethyl-2H-pyridin-1-ium-5-yl)oxy]acetic acid CAS Name: 2-[(2-bromo-6-chloro-1,1-dimethyl-2H-pyridin-1-ium-5-yl)oxy]acetic acid IUPAC Name: 2-[(2-bromo-6-chloro-1,1-dimethyl-2H-pyridin-1-ium-5-yl)oxy]acetic acid Traditional Name: 2-[(2-bromo-6-chloro-1,1-dimethyl-2H-pyridin-1-ium-5-yl)oxy]acetic acid Formula: C9H12BrClNO3+ MolecularWeight: 297.55348

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(C=CC(=C1Cl)OCC(=O)O)Br)C

Isomeric SMILES

C[N+]1(C(C=CC(=C1Cl)OCC(=O)O)Br)C

InChI

InChI=1S/C9H11BrClNO3/c1-12(2)7(10)4-3-6(9(12)11)15-5-8(13)14/h3-4,7H,5H2,1-2H3/p+1