3-[2-[4-(2-ethanoyl-5-phenylmethoxy-phenoxy)butoxy]phenyl]propanoic acid

Systemtic Name: 3-[2-[4-(2-ethanoyl-5-phenylmethoxy-phenoxy)butoxy]phenyl]propanoic acid Openeye Name: 3-[2-[4-(2-acetyl-5-benzyloxy-phenoxy)butoxy]phenyl]propanoic acid CAS Name: 3-[2-[4-(2-acetyl-5-phenylmethoxyphenoxy)butoxy]phenyl]propanoic acid IUPAC Name: 3-[2-[4-(2-acetyl-5-phenylmethoxyphenoxy)butoxy]phenyl]propanoic acid Traditional Name: 3-[2-[4-(2-acetyl-5-benzoxy-phenoxy)butoxy]phenyl]propionic acid Formula: C28H30O6 MolecularWeight: 462.5342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)OCCCCOC3=CC=CC=C3CCC(=O)O

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)OCCCCOC3=CC=CC=C3CCC(=O)O

InChI

InChI=1S/C28H30O6/c1-21(29)25-15-14-24(34-20-22-9-3-2-4-10-22)19-27(25)33-18-8-7-17-32-26-12-6-5-11-23(26)13-16-28(30)31/h2-6,9-12,14-15,19H,7-8,13,16-18,20H2,1H3,(H,30,31)