[6-[2,4-bis(oxidanylidene)pyrimidin-1-yl]hexyl-phosphonooxy-phosphoryl]methylphosphonic acid

Systemtic Name: [6-[2,4-bis(oxidanylidene)pyrimidin-1-yl]hexyl-phosphonooxy-phosphoryl]methylphosphonic acid Openeye Name: [6-(2,4-dioxopyrimidin-1-yl)hexyl-phosphonooxy-phosphoryl]methylphosphonic acid CAS Name: [6-(2,4-dioxo-1-pyrimidinyl)hexyl-phosphonooxyphosphoryl]methylphosphonic acid IUPAC Name: [6-(2,4-dioxopyrimidin-1-yl)hexyl-phosphonooxyphosphoryl]methylphosphonic acid Traditional Name: [6-(2,4-diketopyrimidin-1-yl)hexyl-phosphonooxy-phosphoryl]methylphosphonic acid Formula: C11H21N2O10P3 MolecularWeight: 434.213123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H21N2O10P3/c14-10-5-7-13(11(15)12-10)6-3-1-2-4-8-24(16,9-25(17,18)19)23-26(20,21)22/h5,7H,1-4,6,8-9H2,(H,12,14,15)(H2,17,18,19)(H2,20,21,22)