3-methylpent-1-yn-3-ylazanium bromide

Systemtic Name: 3-methylpent-1-yn-3-ylazanium bromide Openeye Name: (1-ethyl-1-methyl-prop-2-ynyl)ammonium bromide CAS Name: 3-methylpent-1-yn-3-ylammonium bromide IUPAC Name: 3-methylpent-1-yn-3-ylazanium bromide Traditional Name: (1-ethyl-1-methyl-prop-2-ynyl)ammonium bromide Formula: C6H12BrN MolecularWeight: 178.07018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C#C)[NH3+].[Br-]

Isomeric SMILES

CCC(C)(C#C)[NH3+].[Br-]

InChI

InChI=1S/C6H11N.BrH/c1-4-6(3,7)5-2;/h1H,5,7H2,2-3H3;1H