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

Systemtic Name: (5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl-ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium Openeye Name: (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl-ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]ammonium CAS Name: (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl-ethyl-[(3-fluoro-4-methoxyphenyl)methyl]ammonium IUPAC Name: (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl-ethyl-[(3-fluoro-4-methoxyphenyl)methyl]azanium Traditional Name: (5-carbethoxy-2-keto-3,4-dihydro-1H-pyrimidin-6-yl)methyl-ethyl-(3-fluoro-4-methoxy-benzyl)ammonium Formula: C18H25FN3O4+ MolecularWeight: 366.407203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24FN3O4/c1-4-22(10-12-6-7-16(25-3)14(19)8-12)11-15-13(17(23)26-5-2)9-20-18(24)21-15/h6-8H,4-5,9-11H2,1-3H3,(H2,20,21,24)/p+1