1-iodanylprop-2-ynyl-phenethyl-di(propan-2-yl)azanium chloride

Systemtic Name: 1-iodanylprop-2-ynyl-phenethyl-di(propan-2-yl)azanium chloride Openeye Name: 1-iodoprop-2-ynyl-diisopropyl-phenethyl-ammonium chloride CAS Name: 1-iodoprop-2-ynyl-phenethyl-di(propan-2-yl)ammonium chloride IUPAC Name: 1-iodoprop-2-ynyl-phenethyl-di(propan-2-yl)azanium chloride Traditional Name: 1-iodoprop-2-ynyl-diisopropyl-phenethyl-ammonium chloride Formula: C17H25ClIN MolecularWeight: 405.74457

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](CCC1=CC=CC=C1)(C(C)C)C(C#C)I.[Cl-]

Isomeric SMILES

CC(C)[N+](CCC1=CC=CC=C1)(C(C)C)C(C#C)I.[Cl-]

InChI

InChI=1S/C17H25IN.ClH/c1-6-17(18)19(14(2)3,15(4)5)13-12-16-10-8-7-9-11-16;/h1,7-11,14-15,17H,12-13H2,2-5H3;1H/q+1;/p-1