2-iodanyl-3-pyridin-1-ium-1-yl-butane-1,4-diol chloride

Systemtic Name: 2-iodanyl-3-pyridin-1-ium-1-yl-butane-1,4-diol chloride Openeye Name: 2-iodo-3-pyridin-1-ium-1-yl-butane-1,4-diol chloride CAS Name: 2-iodo-3-(1-pyridin-1-iumyl)butane-1,4-diol chloride IUPAC Name: 2-iodo-3-pyridin-1-ium-1-ylbutane-1,4-diol chloride Traditional Name: 2-iodo-3-pyridin-1-ium-1-yl-butane-1,4-diol chloride Formula: C9H13ClINO2 MolecularWeight: 329.56249

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C(CO)C(CO)I.[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)C(CO)C(CO)I.[Cl-]

InChI

InChI=1S/C9H13INO2.ClH/c10-8(6-12)9(7-13)11-4-2-1-3-5-11;/h1-5,8-9,12-13H,6-7H2;1H/q+1;/p-1