7-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]heptylphosphonic acid

Systemtic Name: 7-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]heptylphosphonic acid Openeye Name: 7-(5-methyl-2,4-dioxo-pyrimidin-1-yl)heptylphosphonic acid CAS Name: 7-(5-methyl-2,4-dioxo-1-pyrimidinyl)heptylphosphonic acid IUPAC Name: 7-(5-methyl-2,4-dioxopyrimidin-1-yl)heptylphosphonic acid Traditional Name: 7-(2,4-diketo-5-methyl-pyrimidin-1-yl)heptylphosphonic acid Formula: C12H21N2O5P MolecularWeight: 304.279301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)CCCCCCCP(=O)(O)O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)CCCCCCCP(=O)(O)O

InChI

InChI=1S/C12H21N2O5P/c1-10-9-14(12(16)13-11(10)15)7-5-3-2-4-6-8-20(17,18)19/h9H,2-8H2,1H3,(H,13,15,16)(H2,17,18,19)