2-(carboxymethyloxy)-2-[2-(hydroxymethyl)-5-phenylmethoxy-phenoxy]-3-phenyl-propanoic acid

Systemtic Name: 2-(carboxymethyloxy)-2-[2-(hydroxymethyl)-5-phenylmethoxy-phenoxy]-3-phenyl-propanoic acid Openeye Name: 2-[5-benzyloxy-2-(hydroxymethyl)phenoxy]-2-(carboxymethyloxy)-3-phenyl-propanoic acid CAS Name: 2-(carboxymethyloxy)-2-[2-(hydroxymethyl)-5-phenylmethoxyphenoxy]-3-phenylpropanoic acid IUPAC Name: 2-(carboxymethyloxy)-2-[2-(hydroxymethyl)-5-phenylmethoxyphenoxy]-3-phenylpropanoic acid Traditional Name: 2-(5-benzoxy-2-methylol-phenoxy)-2-(carboxymethyloxy)-3-phenyl-propionic acid Formula: C25H24O8 MolecularWeight: 452.45326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)(OCC(=O)O)OC2=C(C=CC(=C2)OCC3=CC=CC=C3)CO

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)(OCC(=O)O)OC2=C(C=CC(=C2)OCC3=CC=CC=C3)CO

InChI

InChI=1S/C25H24O8/c26-15-20-11-12-21(31-16-19-9-5-2-6-10-19)13-22(20)33-25(24(29)30,32-17-23(27)28)14-18-7-3-1-4-8-18/h1-13,26H,14-17H2,(H,27,28)(H,29,30)