4-[[[2-(carboxymethyloxy)phenyl]-diethoxyphosphoryl-methyl]amino]benzoic acid

Systemtic Name: 4-[[[2-(carboxymethyloxy)phenyl]-diethoxyphosphoryl-methyl]amino]benzoic acid Openeye Name: 4-[[[2-(carboxymethyloxy)phenyl]-diethoxyphosphoryl-methyl]amino]benzoic acid CAS Name: 4-[[[2-(carboxymethyloxy)phenyl]-diethoxyphosphorylmethyl]amino]benzoic acid IUPAC Name: 4-[[[2-(carboxymethyloxy)phenyl]-diethoxyphosphorylmethyl]amino]benzoic acid Traditional Name: 4-[[[2-(carboxymethyloxy)phenyl]-diethoxyphosphoryl-methyl]amino]benzoic acid Formula: C20H24NO8P MolecularWeight: 437.380221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC=CC=C1OCC(=O)O)NC2=CC=C(C=C2)C(=O)O)OCC

Isomeric SMILES

CCOP(=O)(C(C1=CC=CC=C1OCC(=O)O)NC2=CC=C(C=C2)C(=O)O)OCC

InChI

InChI=1S/C20H24NO8P/c1-3-28-30(26,29-4-2)19(21-15-11-9-14(10-12-15)20(24)25)16-7-5-6-8-17(16)27-13-18(22)23/h5-12,19,21H,3-4,13H2,1-2H3,(H,22,23)(H,24,25)