[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-ethynyl-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-ethynyl-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [5-(4-amino-2-oxo-pyrimidin-1-yl)-3-ethynyl-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [5-(4-amino-2-oxo-1-pyrimidinyl)-3-ethynyl-3,4-dihydroxy-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [5-(4-amino-2-oxopyrimidin-1-yl)-3-ethynyl-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [5-(4-amino-2-keto-pyrimidin-1-yl)-3-ethynyl-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C11H14N3O8P MolecularWeight: 347.217921

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(C(OC(C1O)N2C=CC(=NC2=O)N)COP(=O)(O)O)O

Isomeric SMILES

C#CC1(C(OC(C1O)N2C=CC(=NC2=O)N)COP(=O)(O)O)O

InChI

InChI=1S/C11H14N3O8P/c1-2-11(17)6(5-21-23(18,19)20)22-9(8(11)15)14-4-3-7(12)13-10(14)16/h1,3-4,6,8-9,15,17H,5H2,(H2,12,13,16)(H2,18,19,20)