[2-[[3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-1-oxopropyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[3-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)propanoylamino]methyl]benzyl]-dimethyl-ammonium Formula: C19H27N4O2+ MolecularWeight: 343.44328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C)CCC(=O)NCC2=CC=CC=C2C[NH+](C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C)CCC(=O)NCC2=CC=CC=C2C[NH+](C)C

InChI

InChI=1S/C19H26N4O2/c1-13-17(19(25)22-14(2)21-13)9-10-18(24)20-11-15-7-5-6-8-16(15)12-23(3)4/h5-8H,9-12H2,1-4H3,(H,20,24)(H,21,22,25)/p+1