copper; [[2-(hydroxymethyl)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-3-yl]oxy-[[2-(4-methylpyridin-2-yl)pyridin-4-yl]methyl]phosphoryl]oxyazanium; dihydrate

Systemtic Name: copper; [[2-(hydroxymethyl)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-3-yl]oxy-[[2-(4-methylpyridin-2-yl)pyridin-4-yl]methyl]phosphoryl]oxyazanium; dihydrate Openeye Name: copper; [[2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl]oxy-[[2-(4-methyl-2-pyridyl)-4-pyridyl]methyl]phosphoryl]oxyammonium; dihydrate CAS Name: copper; [[2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-3-oxolanyl]oxy-[[2-(4-methyl-2-pyridinyl)-4-pyridinyl]methyl]phosphoryl]oxyammonium; dihydrate IUPAC Name: copper; [[2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-[[2-(4-methylpyridin-2-yl)pyridin-4-yl]methyl]phosphoryl]oxyazanium; dihydrate Traditional Name: copper; [[5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-2-methylol-tetrahydrofuran-3-yl]oxy-[[2-(4-methyl-2-pyridyl)-4-pyridyl]methyl]phosphoryl]oxyammonium; dihydrate Formula: C22H31CuN5O9P+ MolecularWeight: 604.029401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C2=NC=CC(=C2)CP(=O)(OC3CC(OC3CO)N4C=C(C(=O)NC4=O)C)O[NH3+].O.O.[Cu]

Isomeric SMILES

CC1=CC(=NC=C1)C2=NC=CC(=C2)CP(=O)(OC3CC(OC3CO)N4C=C(C(=O)NC4=O)C)O[NH3+].O.O.[Cu]

InChI

InChI=1S/C22H26N5O7P.Cu.2H2O/c1-13-3-5-24-16(7-13)17-8-15(4-6-25-17)12-35(31,34-23)33-18-9-20(32-19(18)11-28)27-10-14(2)21(29)26-22(27)30;;;/h3-8,10,18-20,28H,9,11-12H2,1-2,23H3;;2*1H2/p+1