[3-azido-5-[2-oxidanylidene-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate

Systemtic Name: [3-azido-5-[2-oxidanylidene-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate Openeye Name: [3-azido-5-[2-oxo-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [3-azido-5-[2-oxo-4-(1,2,4-triazol-1-yl)-1-pyrimidinyl]-2-oxolanyl]methyl ester IUPAC Name: [3-azido-5-[2-oxo-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]oxolan-2-yl]methyl acetate Traditional Name: acetic acid [3-azido-5-[2-keto-4-(1,2,4-triazol-1-yl)pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl ester Formula: C13H14N8O4 MolecularWeight: 346.30146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(CC(O1)N2C=CC(=NC2=O)N3C=NC=N3)N=[N+]=[N-]

Isomeric SMILES

CC(=O)OCC1C(CC(O1)N2C=CC(=NC2=O)N3C=NC=N3)N=[N+]=[N-]

InChI

InChI=1S/C13H14N8O4/c1-8(22)24-5-10-9(18-19-14)4-12(25-10)20-3-2-11(17-13(20)23)21-7-15-6-16-21/h2-3,6-7,9-10,12H,4-5H2,1H3