3-[4-[4-(2-carboxyethyl)-2,6-dimethoxy-phenoxy]-3-methoxy-phenyl]propanoic acid

Systemtic Name: 3-[4-[4-(2-carboxyethyl)-2,6-dimethoxy-phenoxy]-3-methoxy-phenyl]propanoic acid Openeye Name: 3-[4-[4-(2-carboxyethyl)-2,6-dimethoxy-phenoxy]-3-methoxy-phenyl]propanoic acid CAS Name: 3-[4-[4-(2-carboxyethyl)-2,6-dimethoxyphenoxy]-3-methoxyphenyl]propanoic acid IUPAC Name: 3-[4-[4-(2-carboxyethyl)-2,6-dimethoxyphenoxy]-3-methoxyphenyl]propanoic acid Traditional Name: 3-[4-[4-(2-carboxyethyl)-2,6-dimethoxy-phenoxy]-3-methoxy-phenyl]propionic acid Formula: C21H24O8 MolecularWeight: 404.41046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC2=C(C=C(C=C2)CCC(=O)O)OC)OC)CCC(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC2=C(C=C(C=C2)CCC(=O)O)OC)OC)CCC(=O)O

InChI

InChI=1S/C21H24O8/c1-26-16-10-13(5-8-19(22)23)4-7-15(16)29-21-17(27-2)11-14(6-9-20(24)25)12-18(21)28-3/h4,7,10-12H,5-6,8-9H2,1-3H3,(H,22,23)(H,24,25)