hexyl 6-[1-(3-iodanylprop-2-ynyl)pyrrolidin-1-ium-1-yl]hexanoate

Systemtic Name: hexyl 6-[1-(3-iodanylprop-2-ynyl)pyrrolidin-1-ium-1-yl]hexanoate Openeye Name: hexyl 6-[1-(3-iodoprop-2-ynyl)pyrrolidin-1-ium-1-yl]hexanoate CAS Name: 6-[1-(3-iodoprop-2-ynyl)-1-pyrrolidin-1-iumyl]hexanoic acid hexyl ester IUPAC Name: hexyl 6-[1-(3-iodoprop-2-ynyl)pyrrolidin-1-ium-1-yl]hexanoate Traditional Name: 6-[1-(3-iodoprop-2-ynyl)pyrrolidin-1-ium-1-yl]hexanoic acid hexyl ester Formula: C19H33INO2+ MolecularWeight: 434.37529

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCCC[N+]1(CCCC1)CC#CI

Isomeric SMILES

CCCCCCOC(=O)CCCCC[N+]1(CCCC1)CC#CI

InChI

InChI=1S/C19H33INO2/c1-2-3-4-10-18-23-19(22)12-6-5-7-14-21(17-11-13-20)15-8-9-16-21/h2-10,12,14-18H2,1H3/q+1