[(2S,5R)-5-(4-azanyl-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl 4-methoxybenzoate

Systemtic Name: [(2S,5R)-5-(4-azanyl-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl 4-methoxybenzoate Openeye Name: [(2S,5R)-5-(4-amino-5-fluoro-2-oxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [(2S,5R)-5-(4-amino-5-fluoro-2-oxo-1-pyrimidinyl)-2,5-dihydrofuran-2-yl]methyl ester IUPAC Name: [(2S,5R)-5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(2S,5R)-5-(4-amino-5-fluoro-2-keto-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl ester Formula: C17H16FN3O5 MolecularWeight: 361.324443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OCC2C=CC(O2)N3C=C(C(=NC3=O)N)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC[C@@H]2C=C[C@@H](O2)N3C=C(C(=NC3=O)N)F

InChI

InChI=1S/C17H16FN3O5/c1-24-11-4-2-10(3-5-11)16(22)25-9-12-6-7-14(26-12)21-8-13(18)15(19)20-17(21)23/h2-8,12,14H,9H2,1H3,(H2,19,20,23)/t12-,14+/m0/s1