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

Systemtic Name: 1-iodanylprop-2-ynyl-(phenylmethyl)-di(propan-2-yl)azanium chloride Openeye Name: benzyl-(1-iodoprop-2-ynyl)-diisopropyl-ammonium chloride CAS Name: 1-iodoprop-2-ynyl-(phenylmethyl)-di(propan-2-yl)ammonium chloride IUPAC Name: benzyl-(1-iodoprop-2-ynyl)-di(propan-2-yl)azanium chloride Traditional Name: benzyl-(1-iodoprop-2-ynyl)-diisopropyl-ammonium chloride Formula: C16H23ClIN MolecularWeight: 391.71799

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](CC1=CC=CC=C1)(C(C)C)C(C#C)I.[Cl-]

Isomeric SMILES

CC(C)[N+](CC1=CC=CC=C1)(C(C)C)C(C#C)I.[Cl-]

InChI

InChI=1S/C16H23IN.ClH/c1-6-16(17)18(13(2)3,14(4)5)12-15-10-8-7-9-11-15;/h1,7-11,13-14,16H,12H2,2-5H3;1H/q+1;/p-1