(Z)-3-(3-methylimidazol-3-ium-1-yl)-1-phenyl-but-2-en-1-one

Systemtic Name: (Z)-3-(3-methylimidazol-3-ium-1-yl)-1-phenyl-but-2-en-1-one Openeye Name: (Z)-3-(3-methylimidazol-3-ium-1-yl)-1-phenyl-but-2-en-1-one CAS Name: (Z)-3-(3-methyl-1-imidazol-3-iumyl)-1-phenyl-2-buten-1-one IUPAC Name: (Z)-3-(3-methylimidazol-3-ium-1-yl)-1-phenylbut-2-en-1-one Traditional Name: (Z)-3-(3-methylimidazol-3-ium-1-yl)-1-phenyl-but-2-en-1-one Formula: C14H15N2O+ MolecularWeight: 227.2817

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N2O/c1-12(16-9-8-15(2)11-16)10-14(17)13-6-4-3-5-7-13/h3-11H,1-2H3/q+1/b12-10-