3,5-bis(dimethoxyphosphorylmethyl)benzoate

Systemtic Name: 3,5-bis(dimethoxyphosphorylmethyl)benzoate Openeye Name: 3,5-bis(dimethoxyphosphorylmethyl)benzoate CAS Name: 3,5-bis(dimethoxyphosphorylmethyl)benzoate IUPAC Name: 3,5-bis(dimethoxyphosphorylmethyl)benzoate Traditional Name: 3,5-bis(dimethoxyphosphorylmethyl)benzoate Formula: C13H19O8P2- MolecularWeight: 365.232682

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(CC1=CC(=CC(=C1)C(=O)[O-])CP(=O)(OC)OC)OC

Isomeric SMILES

COP(=O)(CC1=CC(=CC(=C1)C(=O)[O-])CP(=O)(OC)OC)OC

InChI

InChI=1S/C13H20O8P2/c1-18-22(16,19-2)8-10-5-11(7-12(6-10)13(14)15)9-23(17,20-3)21-4/h5-7H,8-9H2,1-4H3,(H,14,15)/p-1