N2,N4,1,6-tetramethyl-N4-phenethyl-pyrimidin-1-ium-2,4-diamine bromide

Systemtic Name: N2,N4,1,6-tetramethyl-N4-phenethyl-pyrimidin-1-ium-2,4-diamine bromide Openeye Name: N2,N4,1,6-tetramethyl-N4-phenethyl-pyrimidin-1-ium-2,4-diamine bromide CAS Name: N2,N4,1,6-tetramethyl-N4-phenethylpyrimidin-1-ium-2,4-diamine bromide IUPAC Name: 2-N,4-N,1,6-tetramethyl-4-N-phenethylpyrimidin-1-ium-2,4-diamine bromide Traditional Name: [1,6-dimethyl-2-(methylamino)pyrimidin-1-ium-4-yl]-methyl-phenethyl-amine bromide Formula: C16H23BrN4 MolecularWeight: 351.28462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=[N+]1C)NC)N(C)CCC2=CC=CC=C2.[Br-]

Isomeric SMILES

CC1=CC(=NC(=[N+]1C)NC)N(C)CCC2=CC=CC=C2.[Br-]

InChI

InChI=1S/C16H22N4.BrH/c1-13-12-15(18-16(17-2)20(13)4)19(3)11-10-14-8-6-5-7-9-14;/h5-9,12H,10-11H2,1-4H3;1H