[(2S,4S,5R)-5-(4-azido-2-oxidanylidene-pyrimidin-1-yl)-4-fluoranyl-oxolan-2-yl]methyl benzoate

Systemtic Name: [(2S,4S,5R)-5-(4-azido-2-oxidanylidene-pyrimidin-1-yl)-4-fluoranyl-oxolan-2-yl]methyl benzoate Openeye Name: [(2S,4S,5R)-5-(4-azido-2-oxo-pyrimidin-1-yl)-4-fluoro-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [(2S,4S,5R)-5-(4-azido-2-oxo-1-pyrimidinyl)-4-fluoro-2-oxolanyl]methyl ester IUPAC Name: [(2S,4S,5R)-5-(4-azido-2-oxopyrimidin-1-yl)-4-fluorooxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2S,4S,5R)-5-(4-azido-2-keto-pyrimidin-1-yl)-4-fluoro-tetrahydrofuran-2-yl]methyl ester Formula: C16H14FN5O4 MolecularWeight: 359.311863

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(C1F)N2C=CC(=NC2=O)N=[N+]=[N-])COC(=O)C3=CC=CC=C3

Isomeric SMILES

C1[C@H](O[C@H]([C@H]1F)N2C=CC(=NC2=O)N=[N+]=[N-])COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H14FN5O4/c17-12-8-11(9-25-15(23)10-4-2-1-3-5-10)26-14(12)22-7-6-13(20-21-18)19-16(22)24/h1-7,11-12,14H,8-9H2/t11-,12-,14+/m0/s1