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

Systemtic Name: [3-acetyloxy-5-[5-(aminomethyl)-4-azanyl-2-oxidanylidene-pyrimidin-1-yl]-4-fluoranyl-oxolan-2-yl]methyl benzoate Openeye Name: [3-acetoxy-5-[4-amino-5-(aminomethyl)-2-oxo-pyrimidin-1-yl]-4-fluoro-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [3-acetyloxy-5-[4-amino-5-(aminomethyl)-2-oxo-1-pyrimidinyl]-4-fluoro-2-oxolanyl]methyl ester IUPAC Name: [3-acetyloxy-5-[4-amino-5-(aminomethyl)-2-oxopyrimidin-1-yl]-4-fluorooxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [3-acetoxy-5-[4-amino-5-(aminomethyl)-2-keto-pyrimidin-1-yl]-4-fluoro-tetrahydrofuran-2-yl]methyl ester Formula: C19H21FN4O6 MolecularWeight: 420.391643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21FN4O6/c1-10(25)29-15-13(9-28-18(26)11-5-3-2-4-6-11)30-17(14(15)20)24-8-12(7-21)16(22)23-19(24)27/h2-6,8,13-15,17H,7,9,21H2,1H3,(H2,22,23,27)