3-[2-(2-methylpropoxy)-5-(4-phenylmethoxyphenyl)carbonyl-phenyl]propanoic acid

Systemtic Name: 3-[2-(2-methylpropoxy)-5-(4-phenylmethoxyphenyl)carbonyl-phenyl]propanoic acid Openeye Name: 3-[5-(4-benzyloxybenzoyl)-2-isobutoxy-phenyl]propanoic acid CAS Name: 3-[2-(2-methylpropoxy)-5-[oxo-(4-phenylmethoxyphenyl)methyl]phenyl]propanoic acid IUPAC Name: 3-[2-(2-methylpropoxy)-5-(4-phenylmethoxybenzoyl)phenyl]propanoic acid Traditional Name: 3-[5-(4-benzoxybenzoyl)-2-isobutoxy-phenyl]propionic acid Formula: C27H28O5 MolecularWeight: 432.50822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)CCC(=O)O

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)CCC(=O)O

InChI

InChI=1S/C27H28O5/c1-19(2)17-32-25-14-10-23(16-22(25)11-15-26(28)29)27(30)21-8-12-24(13-9-21)31-18-20-6-4-3-5-7-20/h3-10,12-14,16,19H,11,15,17-18H2,1-2H3,(H,28,29)