1-(3-iodanylprop-2-ynyl)-1-pentadecyl-pyrrolidin-1-ium; methanesulfonate

Systemtic Name: 1-(3-iodanylprop-2-ynyl)-1-pentadecyl-pyrrolidin-1-ium; methanesulfonate Openeye Name: 1-(3-iodoprop-2-ynyl)-1-pentadecyl-pyrrolidin-1-ium; methanesulfonate CAS Name: 1-(3-iodoprop-2-ynyl)-1-pentadecylpyrrolidin-1-ium; methanesulfonate IUPAC Name: 1-(3-iodoprop-2-ynyl)-1-pentadecylpyrrolidin-1-ium; methanesulfonate Traditional Name: 1-(3-iodoprop-2-ynyl)-1-pentadecyl-pyrrolidin-1-ium mesylate Formula: C23H44INO3S MolecularWeight: 541.56983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC[N+]1(CCCC1)CC#CI.CS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCC[N+]1(CCCC1)CC#CI.CS(=O)(=O)[O-]

InChI

InChI=1S/C22H41IN.CH4O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-24(22-17-18-23)20-15-16-21-24;1-5(2,3)4/h2-16,19-22H2,1H3;1H3,(H,2,3,4)/q+1;/p-1