[2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]ethoxymethyl-phosphonooxy-phosphoryl]methylphosphonic acid

Systemtic Name: [2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]ethoxymethyl-phosphonooxy-phosphoryl]methylphosphonic acid Openeye Name: [2-(2,4-dioxopyrimidin-1-yl)ethoxymethyl-phosphonooxy-phosphoryl]methylphosphonic acid CAS Name: [2-(2,4-dioxo-1-pyrimidinyl)ethoxymethyl-phosphonooxyphosphoryl]methylphosphonic acid IUPAC Name: [2-(2,4-dioxopyrimidin-1-yl)ethoxymethyl-phosphonooxyphosphoryl]methylphosphonic acid Traditional Name: [2-(2,4-diketopyrimidin-1-yl)ethoxymethyl-phosphonooxy-phosphoryl]methylphosphonic acid Formula: C8H15N2O11P3 MolecularWeight: 408.132783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)NC1=O)CCOCP(=O)(CP(=O)(O)O)OP(=O)(O)O

Isomeric SMILES

C1=CN(C(=O)NC1=O)CCOCP(=O)(CP(=O)(O)O)OP(=O)(O)O

InChI

InChI=1S/C8H15N2O11P3/c11-7-1-2-10(8(12)9-7)3-4-20-5-22(13,6-23(14,15)16)21-24(17,18)19/h1-2H,3-6H2,(H,9,11,12)(H2,14,15,16)(H2,17,18,19)