dimethyl-[3-[[4-oxidanyl-6-oxidanylidene-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-2-yl]amino]propyl]azanium

Systemtic Name: dimethyl-[3-[[4-oxidanyl-6-oxidanylidene-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-2-yl]amino]propyl]azanium Openeye Name: 3-[[4-hydroxy-5-[(4-isopropoxyphenyl)methyl]-6-oxo-1H-pyrimidin-2-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[4-hydroxy-6-oxo-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-2-yl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-hydroxy-6-oxo-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-2-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[4-hydroxy-5-(4-isopropoxybenzyl)-6-keto-1H-pyrimidin-2-yl]amino]propyl-dimethyl-ammonium Formula: C19H29N4O3+ MolecularWeight: 361.45856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CC2=C(N=C(NC2=O)NCCC[NH+](C)C)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CC2=C(N=C(NC2=O)NCCC[NH+](C)C)O

InChI

InChI=1S/C19H28N4O3/c1-13(2)26-15-8-6-14(7-9-15)12-16-17(24)21-19(22-18(16)25)20-10-5-11-23(3)4/h6-9,13H,5,10-12H2,1-4H3,(H3,20,21,22,24,25)/p+1