[3-acetyloxy-5-(4-azanyl-5-iodanyl-2-oxidanylidene-pyrimidin-1-yl)-4-fluoranyl-oxolan-2-yl]methyl benzoate

Systemtic Name: [3-acetyloxy-5-(4-azanyl-5-iodanyl-2-oxidanylidene-pyrimidin-1-yl)-4-fluoranyl-oxolan-2-yl]methyl benzoate Openeye Name: [3-acetoxy-5-(4-amino-5-iodo-2-oxo-pyrimidin-1-yl)-4-fluoro-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [3-acetyloxy-5-(4-amino-5-iodo-2-oxo-1-pyrimidinyl)-4-fluoro-2-oxolanyl]methyl ester IUPAC Name: [3-acetyloxy-5-(4-amino-5-iodo-2-oxopyrimidin-1-yl)-4-fluorooxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [3-acetoxy-5-(4-amino-5-iodo-2-keto-pyrimidin-1-yl)-4-fluoro-tetrahydrofuran-2-yl]methyl ester Formula: C18H17FIN3O6 MolecularWeight: 517.246953

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C1F)N2C=C(C(=NC2=O)N)I)COC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1C(OC(C1F)N2C=C(C(=NC2=O)N)I)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17FIN3O6/c1-9(24)28-14-12(8-27-17(25)10-5-3-2-4-6-10)29-16(13(14)19)23-7-11(20)15(21)22-18(23)26/h2-7,12-14,16H,8H2,1H3,(H2,21,22,26)