methyl (2S,4R)-4-acetyloxy-2-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]pyrrolidine-1-carboxylate

Systemtic Name: methyl (2S,4R)-4-acetyloxy-2-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]pyrrolidine-1-carboxylate Openeye Name: methyl (2S,4R)-4-acetoxy-2-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)pyrrolidine-1-carboxylate CAS Name: (2S,4R)-4-acetyloxy-2-(5-fluoro-2,4-dioxo-1-pyrimidinyl)-1-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-4-acetyloxy-2-(5-fluoro-2,4-dioxopyrimidin-1-yl)pyrrolidine-1-carboxylate Traditional Name: (2S,4R)-4-acetoxy-2-(5-fluoro-2,4-diketo-pyrimidin-1-yl)pyrrolidine-1-carboxylic acid methyl ester Formula: C12H14FN3O6 MolecularWeight: 315.254463

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(N(C1)C(=O)OC)N2C=C(C(=O)NC2=O)F

Isomeric SMILES

CC(=O)O[C@@H]1C[C@H](N(C1)C(=O)OC)N2C=C(C(=O)NC2=O)F

InChI

InChI=1S/C12H14FN3O6/c1-6(17)22-7-3-9(16(4-7)12(20)21-2)15-5-8(13)10(18)14-11(15)19/h5,7,9H,3-4H2,1-2H3,(H,14,18,19)/t7-,9+/m1/s1