(2,4-dichlorophenyl)methyl-(1-iodanylprop-2-ynyl)-dimethyl-azanium chloride

Systemtic Name: (2,4-dichlorophenyl)methyl-(1-iodanylprop-2-ynyl)-dimethyl-azanium chloride Openeye Name: (2,4-dichlorophenyl)methyl-(1-iodoprop-2-ynyl)-dimethyl-ammonium chloride CAS Name: (2,4-dichlorophenyl)methyl-(1-iodoprop-2-ynyl)-dimethylammonium chloride IUPAC Name: (2,4-dichlorophenyl)methyl-(1-iodoprop-2-ynyl)-dimethylazanium chloride Traditional Name: (2,4-dichlorobenzyl)-(1-iodoprop-2-ynyl)-dimethyl-ammonium chloride Formula: C12H13Cl3IN MolecularWeight: 404.50179

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13Cl2IN.ClH/c1-4-12(15)16(2,3)8-9-5-6-10(13)7-11(9)14;/h1,5-7,12H,8H2,2-3H3;1H/q+1;/p-1