2-[2-[3-(1,3-benzodioxol-5-yloxy)-2-ethoxycarbonyl-phenoxy]-5-methoxy-phenyl]propanoic acid

Systemtic Name: 2-[2-[3-(1,3-benzodioxol-5-yloxy)-2-ethoxycarbonyl-phenoxy]-5-methoxy-phenyl]propanoic acid Openeye Name: 2-[2-[3-(1,3-benzodioxol-5-yloxy)-2-ethoxycarbonyl-phenoxy]-5-methoxy-phenyl]propanoic acid CAS Name: 2-[2-[3-(1,3-benzodioxol-5-yloxy)-2-ethoxycarbonylphenoxy]-5-methoxyphenyl]propanoic acid IUPAC Name: 2-[2-[3-(1,3-benzodioxol-5-yloxy)-2-ethoxycarbonylphenoxy]-5-methoxyphenyl]propanoic acid Traditional Name: 2-[2-[3-(1,3-benzodioxol-5-yloxy)-2-carbethoxy-phenoxy]-5-methoxy-phenyl]propionic acid Formula: C26H24O9 MolecularWeight: 480.46336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC=C1OC2=C(C=C(C=C2)OC)C(C)C(=O)O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1=C(C=CC=C1OC2=C(C=C(C=C2)OC)C(C)C(=O)O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H24O9/c1-4-31-26(29)24-21(34-17-9-11-20-23(13-17)33-14-32-20)6-5-7-22(24)35-19-10-8-16(30-3)12-18(19)15(2)25(27)28/h5-13,15H,4,14H2,1-3H3,(H,27,28)