[4-ethanoyl-5-methyl-3,6-bis(oxidanylidene)piperazin-2-yl]methyl dihydrogen phosphate

Systemtic Name: [4-ethanoyl-5-methyl-3,6-bis(oxidanylidene)piperazin-2-yl]methyl dihydrogen phosphate Openeye Name: (4-acetyl-5-methyl-3,6-dioxo-piperazin-2-yl)methyl dihydrogen phosphate CAS Name: (4-acetyl-5-methyl-3,6-dioxo-2-piperazinyl)methyl dihydrogen phosphate IUPAC Name: (4-acetyl-5-methyl-3,6-dioxopiperazin-2-yl)methyl dihydrogen phosphate Traditional Name: (4-acetyl-3,6-diketo-5-methyl-piperazin-2-yl)methyl dihydrogen phosphate Formula: C8H13N2O7P MolecularWeight: 280.171781

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC(C(=O)N1C(=O)C)COP(=O)(O)O

Isomeric SMILES

CC1C(=O)NC(C(=O)N1C(=O)C)COP(=O)(O)O

InChI

InChI=1S/C8H13N2O7P/c1-4-7(12)9-6(3-17-18(14,15)16)8(13)10(4)5(2)11/h4,6H,3H2,1-2H3,(H,9,12)(H2,14,15,16)