[2-[3-(hydroxymethyl)phenoxy]-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-[3-(hydroxymethyl)phenoxy]-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-[3-(hydroxymethyl)phenoxy]-1-phosphono-ethyl]phosphonic acid CAS Name: [2-[3-(hydroxymethyl)phenoxy]-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-[3-(hydroxymethyl)phenoxy]-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(3-methylolphenoxy)-1-phosphono-ethyl]phosphonic acid Formula: C9H14O8P2 MolecularWeight: 312.150182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(P(=O)(O)O)P(=O)(O)O)CO

Isomeric SMILES

C1=CC(=CC(=C1)OCC(P(=O)(O)O)P(=O)(O)O)CO

InChI

InChI=1S/C9H14O8P2/c10-5-7-2-1-3-8(4-7)17-6-9(18(11,12)13)19(14,15)16/h1-4,9-10H,5-6H2,(H2,11,12,13)(H2,14,15,16)