1-(4-tert-butylphenyl)-2-pyrazin-1-ium-1-yl-ethanone

Systemtic Name: 1-(4-tert-butylphenyl)-2-pyrazin-1-ium-1-yl-ethanone Openeye Name: 1-(4-tert-butylphenyl)-2-pyrazin-1-ium-1-yl-ethanone CAS Name: 1-(4-tert-butylphenyl)-2-(1-pyrazin-1-iumyl)ethanone IUPAC Name: 1-(4-tert-butylphenyl)-2-pyrazin-1-ium-1-ylethanone Traditional Name: 1-(4-tert-butylphenyl)-2-pyrazin-1-ium-1-yl-ethanone Formula: C16H19N2O+ MolecularWeight: 255.33486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C[N+]2=CC=NC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C[N+]2=CC=NC=C2

InChI

InChI=1S/C16H19N2O/c1-16(2,3)14-6-4-13(5-7-14)15(19)12-18-10-8-17-9-11-18/h4-11H,12H2,1-3H3/q+1