1-[4-(3-methylimidazol-3-ium-1-yl)phenyl]ethanone

Systemtic Name: 1-[4-(3-methylimidazol-3-ium-1-yl)phenyl]ethanone Openeye Name: 1-[4-(3-methylimidazol-3-ium-1-yl)phenyl]ethanone CAS Name: 1-[4-(3-methyl-1-imidazol-3-iumyl)phenyl]ethanone IUPAC Name: 1-[4-(3-methylimidazol-3-ium-1-yl)phenyl]ethanone Traditional Name: 1-[4-(3-methylimidazol-3-ium-1-yl)phenyl]ethanone Formula: C12H13N2O+ MolecularWeight: 201.24442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C=C[N+](=C2)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C=C[N+](=C2)C

InChI

InChI=1S/C12H13N2O/c1-10(15)11-3-5-12(6-4-11)14-8-7-13(2)9-14/h3-9H,1-2H3/q+1