3-[2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]oxypropanenitrile

Systemtic Name: 3-[2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]oxypropanenitrile Openeye Name: 3-[2-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl]oxypropanenitrile CAS Name: 3-[[2-(2,4-dioxo-1-pyrimidinyl)-4-hydroxy-5-(hydroxymethyl)-3-oxolanyl]oxy]propanenitrile IUPAC Name: 3-[2-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]oxypropanenitrile Traditional Name: 3-[2-(2,4-diketopyrimidin-1-yl)-4-hydroxy-5-methylol-tetrahydrofuran-3-yl]oxypropionitrile Formula: C12H15N3O6 MolecularWeight: 297.264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)OCCC#N

Isomeric SMILES

C1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)OCCC#N

InChI

InChI=1S/C12H15N3O6/c13-3-1-5-20-10-9(18)7(6-16)21-11(10)15-4-2-8(17)14-12(15)19/h2,4,7,9-11,16,18H,1,5-6H2,(H,14,17,19)