1-(3-iodanyl-2-methyl-heptan-2-yl)pyridin-1-ium

Systemtic Name: 1-(3-iodanyl-2-methyl-heptan-2-yl)pyridin-1-ium Openeye Name: 1-(2-iodo-1,1-dimethyl-hexyl)pyridin-1-ium CAS Name: 1-(3-iodo-2-methylheptan-2-yl)pyridin-1-ium IUPAC Name: 1-(3-iodo-2-methylheptan-2-yl)pyridin-1-ium Traditional Name: 1-(2-iodo-1,1-dimethyl-hexyl)pyridin-1-ium Formula: C13H21IN+ MolecularWeight: 318.21701

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21IN/c1-4-5-9-12(14)13(2,3)15-10-7-6-8-11-15/h6-8,10-12H,4-5,9H2,1-3H3/q+1