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

Systemtic Name: 2-[2-(butylamino)pyrimidin-1-ium-1-yl]-1-(4-chlorophenyl)ethanone Openeye Name: 2-[2-(butylamino)pyrimidin-1-ium-1-yl]-1-(4-chlorophenyl)ethanone CAS Name: 2-[2-(butylamino)-1-pyrimidin-1-iumyl]-1-(4-chlorophenyl)ethanone IUPAC Name: 2-[2-(butylamino)pyrimidin-1-ium-1-yl]-1-(4-chlorophenyl)ethanone Traditional Name: 2-[2-(butylamino)pyrimidin-1-ium-1-yl]-1-(4-chlorophenyl)ethanone Formula: C16H19ClN3O+ MolecularWeight: 304.79456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClN3O/c1-2-3-9-18-16-19-10-4-11-20(16)12-15(21)13-5-7-14(17)8-6-13/h4-8,10-11H,2-3,9,12H2,1H3/p+1