(2S)-2-(3-chloranyl-4-oxidanyl-pyridin-1-ium-1-yl)propanoyl chloride chloride

Systemtic Name: (2S)-2-(3-chloranyl-4-oxidanyl-pyridin-1-ium-1-yl)propanoyl chloride chloride Openeye Name: (2S)-2-(3-chloro-4-hydroxy-pyridin-1-ium-1-yl)propanoyl chloride chloride CAS Name: (2S)-2-(3-chloro-4-hydroxy-1-pyridin-1-iumyl)propanoyl chloride chloride IUPAC Name: (2S)-2-(3-chloro-4-hydroxypyridin-1-ium-1-yl)propanoyl chloride chloride Traditional Name: (2S)-2-(3-chloro-4-hydroxy-pyridin-1-ium-1-yl)propionyl chloride chloride Formula: C8H8Cl3NO2 MolecularWeight: 256.51362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)Cl)[N+]1=CC(=C(C=C1)O)Cl.[Cl-]

InChI

InChI=1S/C8H7Cl2NO2.ClH/c1-5(8(10)13)11-3-2-7(12)6(9)4-11;/h2-5H,1H3;1H/t5-;/m0./s1