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

Systemtic Name: [5-(4-azanyl-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl 4-methylbenzoate Openeye Name: [5-(4-amino-5-fluoro-2-oxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid [5-(4-amino-5-fluoro-2-oxo-1-pyrimidinyl)-2,5-dihydrofuran-2-yl]methyl ester IUPAC Name: [5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [5-(4-amino-5-fluoro-2-keto-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl ester Formula: C17H16FN3O4 MolecularWeight: 345.325043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC2C=CC(O2)N3C=C(C(=NC3=O)N)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC2C=CC(O2)N3C=C(C(=NC3=O)N)F

InChI

InChI=1S/C17H16FN3O4/c1-10-2-4-11(5-3-10)16(22)24-9-12-6-7-14(25-12)21-8-13(18)15(19)20-17(21)23/h2-8,12,14H,9H2,1H3,(H2,19,20,23)