dibutyl-(1-iodanylprop-2-ynyl)-(phenylmethyl)azanium chloride

Systemtic Name: dibutyl-(1-iodanylprop-2-ynyl)-(phenylmethyl)azanium chloride Openeye Name: benzyl-dibutyl-(1-iodoprop-2-ynyl)ammonium chloride CAS Name: dibutyl-(1-iodoprop-2-ynyl)-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-dibutyl-(1-iodoprop-2-ynyl)azanium chloride Traditional Name: benzyl-dibutyl-(1-iodoprop-2-ynyl)ammonium chloride Formula: C18H27ClIN MolecularWeight: 419.77115

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27IN.ClH/c1-4-7-14-20(15-8-5-2,18(19)6-3)16-17-12-10-9-11-13-17;/h3,9-13,18H,4-5,7-8,14-16H2,1-2H3;1H/q+1;/p-1