dimethyl-(phenylmethyl)-prop-2-ynyl-azanium bromide

Systemtic Name: dimethyl-(phenylmethyl)-prop-2-ynyl-azanium bromide Openeye Name: benzyl-dimethyl-prop-2-ynyl-ammonium bromide CAS Name: dimethyl-(phenylmethyl)-prop-2-ynylammonium bromide IUPAC Name: benzyl-dimethyl-prop-2-ynylazanium bromide Traditional Name: benzyl-dimethyl-propargyl-ammonium bromide Formula: C12H16BrN MolecularWeight: 254.16614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N.BrH/c1-4-10-13(2,3)11-12-8-6-5-7-9-12;/h1,5-9H,10-11H2,2-3H3;1H/q+1;/p-1