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

Systemtic Name: dimethyl-[[2-[[3-(6-methyl-2-morpholin-4-yl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoylamino]methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[2-[[3-(6-methyl-2-morpholino-4-oxo-1H-pyrimidin-5-yl)propanoylamino]methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[2-[[[3-[6-methyl-2-(4-morpholinyl)-4-oxo-1H-pyrimidin-5-yl]-1-oxopropyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[2-[[3-(6-methyl-2-morpholin-4-yl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]methyl]phenyl]methyl]azanium Traditional Name: [2-[[3-(4-keto-6-methyl-2-morpholino-1H-pyrimidin-5-yl)propanoylamino]methyl]benzyl]-dimethyl-ammonium Formula: C22H32N5O3+ MolecularWeight: 414.52118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2CCOCC2)CCC(=O)NCC3=CC=CC=C3C[NH+](C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2CCOCC2)CCC(=O)NCC3=CC=CC=C3C[NH+](C)C

InChI

InChI=1S/C22H31N5O3/c1-16-19(21(29)25-22(24-16)27-10-12-30-13-11-27)8-9-20(28)23-14-17-6-4-5-7-18(17)15-26(2)3/h4-7H,8-15H2,1-3H3,(H,23,28)(H,24,25,29)/p+1