(2R,3S,4S,5R)-5-azido-5-(hydroxymethyl)-4-oxidanyl-2-(6-oxidanylidene-3H-purin-9-yl)oxolane-3-carbonitrile

Systemtic Name: (2R,3S,4S,5R)-5-azido-5-(hydroxymethyl)-4-oxidanyl-2-(6-oxidanylidene-3H-purin-9-yl)oxolane-3-carbonitrile Openeye Name: (2R,3S,4S,5R)-5-azido-4-hydroxy-5-(hydroxymethyl)-2-(6-oxo-3H-purin-9-yl)tetrahydrofuran-3-carbonitrile CAS Name: (2R,3S,4S,5R)-5-azido-4-hydroxy-5-(hydroxymethyl)-2-(6-oxo-3H-purin-9-yl)-3-oxolanecarbonitrile IUPAC Name: (2R,3S,4S,5R)-5-azido-4-hydroxy-5-(hydroxymethyl)-2-(6-oxo-3H-purin-9-yl)oxolane-3-carbonitrile Traditional Name: (2R,3S,4S,5R)-5-azido-4-hydroxy-2-(6-keto-3H-purin-9-yl)-5-methylol-tetrahydrofuran-3-carbonitrile Formula: C11H10N8O4 MolecularWeight: 318.2483

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)(CO)N=[N+]=[N-])O)C#N

Isomeric SMILES

C1=NC(=O)C2=C(N1)N(C=N2)[C@H]3[C@H]([C@@H]([C@](O3)(CO)N=[N+]=[N-])O)C#N

InChI

InChI=1S/C11H10N8O4/c12-1-5-7(21)11(2-20,17-18-13)23-10(5)19-4-16-6-8(19)14-3-15-9(6)22/h3-5,7,10,20-21H,2H2,(H,14,15,22)/t5-,7-,10+,11+/m0/s1