(E)-3-(3-methylimidazol-3-ium-1-yl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(3-methylimidazol-3-ium-1-yl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(3-methylimidazol-3-ium-1-yl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-(3-methyl-1-imidazol-3-iumyl)-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(3-methylimidazol-3-ium-1-yl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-(3-methylimidazol-3-ium-1-yl)-1-phenyl-prop-2-en-1-one Formula: C13H13N2O+ MolecularWeight: 213.25512

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)C=CC(=O)C2=CC=CC=C2

Isomeric SMILES

C[N+]1=CN(C=C1)/C=C/C(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H13N2O/c1-14-9-10-15(11-14)8-7-13(16)12-5-3-2-4-6-12/h2-11H,1H3/q+1/b8-7+