2-(3,5-dimethylpyrazin-1-ium-1-yl)-1-phenyl-ethanone

Systemtic Name: 2-(3,5-dimethylpyrazin-1-ium-1-yl)-1-phenyl-ethanone Openeye Name: 2-(3,5-dimethylpyrazin-1-ium-1-yl)-1-phenyl-ethanone CAS Name: 2-(3,5-dimethyl-1-pyrazin-1-iumyl)-1-phenylethanone IUPAC Name: 2-(3,5-dimethylpyrazin-1-ium-1-yl)-1-phenylethanone Traditional Name: 2-(3,5-dimethylpyrazin-1-ium-1-yl)-1-phenyl-ethanone Formula: C14H15N2O+ MolecularWeight: 227.2817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC(=N1)C)CC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=C[N+](=CC(=N1)C)CC(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H15N2O/c1-11-8-16(9-12(2)15-11)10-14(17)13-6-4-3-5-7-13/h3-9H,10H2,1-2H3/q+1