[(2S)-1-oxidanyl-3-[2-oxidanylidene-4-(prop-2-enylamino)pyrimidin-1-yl]propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [(2S)-1-oxidanyl-3-[2-oxidanylidene-4-(prop-2-enylamino)pyrimidin-1-yl]propan-2-yl]oxymethylphosphonic acid Openeye Name: [(1S)-1-[[4-(allylamino)-2-oxo-pyrimidin-1-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid CAS Name: [(2S)-1-hydroxy-3-[2-oxo-4-(prop-2-enylamino)-1-pyrimidinyl]propan-2-yl]oxymethylphosphonic acid IUPAC Name: [(2S)-1-hydroxy-3-[2-oxo-4-(prop-2-enylamino)pyrimidin-1-yl]propan-2-yl]oxymethylphosphonic acid Traditional Name: [(1S)-1-[[4-(allylamino)-2-keto-pyrimidin-1-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid Formula: C11H18N3O6P MolecularWeight: 319.250881

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=O)N(C=C1)CC(CO)OCP(=O)(O)O

Isomeric SMILES

C=CCNC1=NC(=O)N(C=C1)C[C@@H](CO)OCP(=O)(O)O

InChI

InChI=1S/C11H18N3O6P/c1-2-4-12-10-3-5-14(11(16)13-10)6-9(7-15)20-8-21(17,18)19/h2-3,5,9,15H,1,4,6-8H2,(H,12,13,16)(H2,17,18,19)/t9-/m0/s1