4-(3-iodanylprop-2-ynyl)-2-pentyl-morpholin-4-ium; methanesulfonate

Systemtic Name: 4-(3-iodanylprop-2-ynyl)-2-pentyl-morpholin-4-ium; methanesulfonate Openeye Name: 4-(3-iodoprop-2-ynyl)-2-pentyl-morpholin-4-ium; methanesulfonate CAS Name: 4-(3-iodoprop-2-ynyl)-2-pentylmorpholin-4-ium; methanesulfonate IUPAC Name: 4-(3-iodoprop-2-ynyl)-2-pentylmorpholin-4-ium; methanesulfonate Traditional Name: 2-amyl-4-(3-iodoprop-2-ynyl)morpholin-4-ium mesylate Formula: C13H24INO4S MolecularWeight: 417.30343

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C[NH+](CCO1)CC#CI.CS(=O)(=O)[O-]

Isomeric SMILES

CCCCCC1C[NH+](CCO1)CC#CI.CS(=O)(=O)[O-]

InChI

InChI=1S/C12H20INO.CH4O3S/c1-2-3-4-6-12-11-14(8-5-7-13)9-10-15-12;1-5(2,3)4/h12H,2-4,6,8-11H2,1H3;1H3,(H,2,3,4)