(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl) 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: (2-azanyl-4-oxidanylidene-1H-pteridin-6-yl) 2,2,2-tris(fluoranyl)ethanoate Openeye Name: (2-amino-4-oxo-1H-pteridin-6-yl) 2,2,2-trifluoroacetate CAS Name: 2,2,2-trifluoroacetic acid (2-amino-4-oxo-1H-pteridin-6-yl) ester IUPAC Name: (2-amino-4-oxo-1H-pteridin-6-yl) 2,2,2-trifluoroacetate Traditional Name: 2,2,2-trifluoroacetic acid (2-amino-4-keto-1H-pteridin-6-yl) ester Formula: C8H4F3N5O3 MolecularWeight: 275.14427

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C2C(=N1)NC(=NC2=O)N)OC(=O)C(F)(F)F

Isomeric SMILES

C1=C(N=C2C(=N1)NC(=NC2=O)N)OC(=O)C(F)(F)F

InChI

InChI=1S/C8H4F3N5O3/c9-8(10,11)6(18)19-2-1-13-4-3(14-2)5(17)16-7(12)15-4/h1H,(H3,12,13,15,16,17)