3-[2-decoxy-5-[(3-ethoxycarbonylphenyl)-oxidanyl-methyl]phenyl]propanoic acid

Systemtic Name: 3-[2-decoxy-5-[(3-ethoxycarbonylphenyl)-oxidanyl-methyl]phenyl]propanoic acid Openeye Name: 3-[2-decoxy-5-[(3-ethoxycarbonylphenyl)-hydroxy-methyl]phenyl]propanoic acid CAS Name: 3-[2-decoxy-5-[(3-ethoxycarbonylphenyl)-hydroxymethyl]phenyl]propanoic acid IUPAC Name: 3-[2-decoxy-5-[(3-ethoxycarbonylphenyl)-hydroxymethyl]phenyl]propanoic acid Traditional Name: 3-[5-[(3-carbethoxyphenyl)-hydroxy-methyl]-2-decoxy-phenyl]propionic acid Formula: C29H40O6 MolecularWeight: 484.6243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)C(C2=CC=CC(=C2)C(=O)OCC)O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)C(C2=CC=CC(=C2)C(=O)OCC)O)CCC(=O)O

InChI

InChI=1S/C29H40O6/c1-3-5-6-7-8-9-10-11-19-35-26-17-15-24(20-22(26)16-18-27(30)31)28(32)23-13-12-14-25(21-23)29(33)34-4-2/h12-15,17,20-21,28,32H,3-11,16,18-19H2,1-2H3,(H,30,31)