1-(phenylmethyl)-3-prop-2-ynyl-imidazol-1-ium

Systemtic Name: 1-(phenylmethyl)-3-prop-2-ynyl-imidazol-1-ium Openeye Name: 1-benzyl-3-prop-2-ynyl-imidazol-1-ium CAS Name: 1-(phenylmethyl)-3-prop-2-ynylimidazol-1-ium IUPAC Name: 1-benzyl-3-prop-2-ynylimidazol-1-ium Traditional Name: 1-benzyl-3-propargyl-imidazol-1-ium Formula: C13H13N2+ MolecularWeight: 197.25572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C=C[N+](=C1)CC2=CC=CC=C2

Isomeric SMILES

C#CCN1C=C[N+](=C1)CC2=CC=CC=C2

InChI

InChI=1S/C13H13N2/c1-2-8-14-9-10-15(12-14)11-13-6-4-3-5-7-13/h1,3-7,9-10,12H,8,11H2/q+1