2-[2-(butylamino)pyrimidin-1-ium-1-yl]-1-(4-ethoxyphenyl)ethanone

Systemtic Name: 2-[2-(butylamino)pyrimidin-1-ium-1-yl]-1-(4-ethoxyphenyl)ethanone Openeye Name: 2-[2-(butylamino)pyrimidin-1-ium-1-yl]-1-(4-ethoxyphenyl)ethanone CAS Name: 2-[2-(butylamino)-1-pyrimidin-1-iumyl]-1-(4-ethoxyphenyl)ethanone IUPAC Name: 2-[2-(butylamino)pyrimidin-1-ium-1-yl]-1-(4-ethoxyphenyl)ethanone Traditional Name: 2-[2-(butylamino)pyrimidin-1-ium-1-yl]-1-p-phenetyl-ethanone Formula: C18H24N3O2+ MolecularWeight: 314.40206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=CC=[N+]1CC(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCNC1=NC=CC=[N+]1CC(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C18H23N3O2/c1-3-5-11-19-18-20-12-6-13-21(18)14-17(22)15-7-9-16(10-8-15)23-4-2/h6-10,12-13H,3-5,11,14H2,1-2H3/p+1