3-iodosyl-1-octyl-pyridin-1-ium-4-carboxylic acid

Systemtic Name: 3-iodosyl-1-octyl-pyridin-1-ium-4-carboxylic acid Openeye Name: 3-iodosyl-1-octyl-pyridin-1-ium-4-carboxylic acid CAS Name: 3-iodosyl-1-octyl-4-pyridin-1-iumcarboxylic acid IUPAC Name: 3-iodosyl-1-octylpyridin-1-ium-4-carboxylic acid Traditional Name: 3-iodosyl-1-octyl-pyridin-1-ium-4-carboxylic acid Formula: C14H21INO3+ MolecularWeight: 378.22591

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1=CC(=C(C=C1)C(=O)O)I=O

Isomeric SMILES

CCCCCCCC[N+]1=CC(=C(C=C1)C(=O)O)I=O

InChI

InChI=1S/C14H20INO3/c1-2-3-4-5-6-7-9-16-10-8-12(14(17)18)13(11-16)15-19/h8,10-11H,2-7,9H2,1H3/p+1