[4-(4-azanyl-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)-5-methyl-1,3-dioxolan-2-yl]methyl benzoate

Systemtic Name: [4-(4-azanyl-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)-5-methyl-1,3-dioxolan-2-yl]methyl benzoate Openeye Name: [4-(4-amino-5-fluoro-2-oxo-pyrimidin-1-yl)-5-methyl-1,3-dioxolan-2-yl]methyl benzoate CAS Name: benzoic acid [4-(4-amino-5-fluoro-2-oxo-1-pyrimidinyl)-5-methyl-1,3-dioxolan-2-yl]methyl ester IUPAC Name: [4-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-5-methyl-1,3-dioxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [4-(4-amino-5-fluoro-2-keto-pyrimidin-1-yl)-5-methyl-1,3-dioxolan-2-yl]methyl ester Formula: C16H16FN3O5 MolecularWeight: 349.313743

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(O1)COC(=O)C2=CC=CC=C2)N3C=C(C(=NC3=O)N)F

Isomeric SMILES

CC1C(OC(O1)COC(=O)C2=CC=CC=C2)N3C=C(C(=NC3=O)N)F

InChI

InChI=1S/C16H16FN3O5/c1-9-14(20-7-11(17)13(18)19-16(20)22)25-12(24-9)8-23-15(21)10-5-3-2-4-6-10/h2-7,9,12,14H,8H2,1H3,(H2,18,19,22)