2-[3,4-bis(oxidanyl)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]ethanenitrile

Systemtic Name: 2-[3,4-bis(oxidanyl)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]ethanenitrile Openeye Name: 2-[3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]acetonitrile CAS Name: 2-[3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)-2-oxolanyl]acetonitrile IUPAC Name: 2-[3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]acetonitrile Traditional Name: 2-[3,4-dihydroxy-5-(6-keto-3H-purin-9-yl)tetrahydrofuran-2-yl]acetonitrile Formula: C11H11N5O4 MolecularWeight: 277.23614

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)CC#N)O)O

Isomeric SMILES

C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)CC#N)O)O

InChI

InChI=1S/C11H11N5O4/c12-2-1-5-7(17)8(18)11(20-5)16-4-15-6-9(16)13-3-14-10(6)19/h3-5,7-8,11,17-18H,1H2,(H,13,14,19)