dipropyl (2S,3S,4R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2-azido-2-(butanoyloxymethyl)oxolane-3,4-dicarboxylate

Systemtic Name: dipropyl (2S,3S,4R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2-azido-2-(butanoyloxymethyl)oxolane-3,4-dicarboxylate Openeye Name: dipropyl (2S,3S,4R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-2-azido-2-(butanoyloxymethyl)tetrahydrofuran-3,4-dicarboxylate CAS Name: (2S,3S,4R)-5-(4-amino-2-oxo-1-pyrimidinyl)-2-azido-2-(1-oxobutoxymethyl)oxolane-3,4-dicarboxylic acid dipropyl ester IUPAC Name: dipropyl (2S,3S,4R)-5-(4-amino-2-oxopyrimidin-1-yl)-2-azido-2-(butanoyloxymethyl)oxolane-3,4-dicarboxylate Traditional Name: (2S,3S,4R)-5-(4-amino-2-keto-pyrimidin-1-yl)-2-azido-2-(butyryloxymethyl)tetrahydrofuran-3,4-dicarboxylic acid dipropyl ester Formula: C21H30N6O8 MolecularWeight: 494.4983

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC1(C(C(C(O1)N2C=CC(=NC2=O)N)C(=O)OCCC)C(=O)OCCC)N=[N+]=[N-]

Isomeric SMILES

CCCC(=O)OC[C@@]1([C@H]([C@H](C(O1)N2C=CC(=NC2=O)N)C(=O)OCCC)C(=O)OCCC)N=[N+]=[N-]

InChI

InChI=1S/C21H30N6O8/c1-4-7-14(28)34-12-21(25-26-23)16(19(30)33-11-6-3)15(18(29)32-10-5-2)17(35-21)27-9-8-13(22)24-20(27)31/h8-9,15-17H,4-7,10-12H2,1-3H3,(H2,22,24,31)/t15-,16-,17?,21-/m1/s1