3-[2,4-bis(oxidanyl)phenyl]-2-diethoxyphosphoryl-propanoic acid

Systemtic Name: 3-[2,4-bis(oxidanyl)phenyl]-2-diethoxyphosphoryl-propanoic acid Openeye Name: 2-diethoxyphosphoryl-3-(2,4-dihydroxyphenyl)propanoic acid CAS Name: 2-diethoxyphosphoryl-3-(2,4-dihydroxyphenyl)propanoic acid IUPAC Name: 2-diethoxyphosphoryl-3-(2,4-dihydroxyphenyl)propanoic acid Traditional Name: 2-diethoxyphosphoryl-3-(2,4-dihydroxyphenyl)propionic acid Formula: C13H19O7P MolecularWeight: 318.259521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CC1=C(C=C(C=C1)O)O)C(=O)O)OCC

Isomeric SMILES

CCOP(=O)(C(CC1=C(C=C(C=C1)O)O)C(=O)O)OCC

InChI

InChI=1S/C13H19O7P/c1-3-19-21(18,20-4-2)12(13(16)17)7-9-5-6-10(14)8-11(9)15/h5-6,8,12,14-15H,3-4,7H2,1-2H3,(H,16,17)