(2,3,4-triethylcyclohexa-1,3-dien-5-yn-1-yl)azanium bromide

Systemtic Name: (2,3,4-triethylcyclohexa-1,3-dien-5-yn-1-yl)azanium bromide Openeye Name: (2,3,4-triethylcyclohexa-1,3-dien-5-yn-1-yl)ammonium bromide CAS Name: (2,3,4-triethyl-1-cyclohexa-1,3-dien-5-ynyl)ammonium bromide IUPAC Name: (2,3,4-triethylcyclohexa-1,3-dien-5-yn-1-yl)azanium bromide Traditional Name: (2,3,4-triethylcyclohexa-1,3-dien-5-yn-1-yl)ammonium bromide Formula: C12H18BrN MolecularWeight: 256.18202

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C#C1)[NH3+])CC)CC.[Br-]

Isomeric SMILES

CCC1=C(C(=C(C#C1)[NH3+])CC)CC.[Br-]

InChI

InChI=1S/C12H17N.BrH/c1-4-9-7-8-12(13)11(6-3)10(9)5-2;/h4-6,13H2,1-3H3;1H