(Z)-2-methyl-4-oxidanylidene-pent-2-eneperoxoic acid phosphate

Systemtic Name: (Z)-2-methyl-4-oxidanylidene-pent-2-eneperoxoic acid phosphate Openeye Name: (Z)-2-methyl-4-oxo-pent-2-eneperoxoic acid phosphate CAS Name: (Z)-2-methyl-4-oxo-2-penteneperoxoic acid phosphate IUPAC Name: (Z)-2-methyl-4-oxopent-2-eneperoxoic acid phosphate Traditional Name: (Z)-4-keto-2-methyl-pent-2-eneperoxoic acid phosphate Formula: C6H8O8P-3 MolecularWeight: 239.096681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)C(=O)OO.[O-]P(=O)([O-])[O-]

Isomeric SMILES

C/C(=C/C(=O)C)/C(=O)OO.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C6H8O4.H3O4P/c1-4(3-5(2)7)6(8)10-9;1-5(2,3)4/h3,9H,1-2H3;(H3,1,2,3,4)/p-3/b4-3-;