[(4R)-5-ethoxycarbonyl-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium

Systemtic Name: [(4R)-5-ethoxycarbonyl-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium Openeye Name: [(4R)-5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]ammonium CAS Name: [(4R)-5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-[(3-fluoro-4-methoxyphenyl)methyl]ammonium IUPAC Name: [(4R)-5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-[(3-fluoro-4-methoxyphenyl)methyl]azanium Traditional Name: [(4R)-5-carbethoxy-2-keto-4-methyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-ethyl-(3-fluoro-4-methoxy-benzyl)ammonium Formula: C19H27FN3O4+ MolecularWeight: 380.433783

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=C(C=C1)OC)F)CC2=C(C(NC(=O)N2)C)C(=O)OCC

Isomeric SMILES

CC[NH+](CC1=CC(=C(C=C1)OC)F)CC2=C([C@H](NC(=O)N2)C)C(=O)OCC

InChI

InChI=1S/C19H26FN3O4/c1-5-23(10-13-7-8-16(26-4)14(20)9-13)11-15-17(18(24)27-6-2)12(3)21-19(25)22-15/h7-9,12H,5-6,10-11H2,1-4H3,(H2,21,22,25)/p+1/t12-/m1/s1