[(2S)-1-[5-ethyl-4-(2-hydroxyethylamino)-2-oxidanylidene-pyrimidin-1-yl]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [(2S)-1-[5-ethyl-4-(2-hydroxyethylamino)-2-oxidanylidene-pyrimidin-1-yl]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid Openeye Name: [(1S)-1-[[5-ethyl-4-(2-hydroxyethylamino)-2-oxo-pyrimidin-1-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid CAS Name: [(2S)-1-[5-ethyl-4-(2-hydroxyethylamino)-2-oxo-1-pyrimidinyl]-3-hydroxypropan-2-yl]oxymethylphosphonic acid IUPAC Name: [(2S)-1-[5-ethyl-4-(2-hydroxyethylamino)-2-oxopyrimidin-1-yl]-3-hydroxypropan-2-yl]oxymethylphosphonic acid Traditional Name: [(1S)-1-[[5-ethyl-4-(2-hydroxyethylamino)-2-keto-pyrimidin-1-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid Formula: C12H22N3O7P MolecularWeight: 351.292741

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C(=O)N=C1NCCO)CC(CO)OCP(=O)(O)O

Isomeric SMILES

CCC1=CN(C(=O)N=C1NCCO)C[C@@H](CO)OCP(=O)(O)O

InChI

InChI=1S/C12H22N3O7P/c1-2-9-5-15(12(18)14-11(9)13-3-4-16)6-10(7-17)22-8-23(19,20)21/h5,10,16-17H,2-4,6-8H2,1H3,(H,13,14,18)(H2,19,20,21)/t10-/m0/s1