[(1S)-2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)-1-(3-fluoranyl-4-methoxy-phenyl)ethyl]azanium

Systemtic Name: [(1S)-2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)-1-(3-fluoranyl-4-methoxy-phenyl)ethyl]azanium Openeye Name: [(1S)-2-(4,6-dimethyl-2-oxo-pyrimidin-1-yl)-1-(3-fluoro-4-methoxy-phenyl)ethyl]ammonium CAS Name: [(1S)-2-(4,6-dimethyl-2-oxo-1-pyrimidinyl)-1-(3-fluoro-4-methoxyphenyl)ethyl]ammonium IUPAC Name: [(1S)-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)-1-(3-fluoro-4-methoxyphenyl)ethyl]azanium Traditional Name: [(1S)-1-(3-fluoro-4-methoxy-phenyl)-2-(2-keto-4,6-dimethyl-pyrimidin-1-yl)ethyl]ammonium Formula: C15H19FN3O2+ MolecularWeight: 292.328663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=O)N1CC(C2=CC(=C(C=C2)OC)F)[NH3+])C

Isomeric SMILES

CC1=CC(=NC(=O)N1C[C@H](C2=CC(=C(C=C2)OC)F)[NH3+])C

InChI

InChI=1S/C15H18FN3O2/c1-9-6-10(2)19(15(20)18-9)8-13(17)11-4-5-14(21-3)12(16)7-11/h4-7,13H,8,17H2,1-3H3/p+1/t13-/m1/s1