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

Systemtic Name: 3-[2-(2-methylpropoxy)-5-(4-propoxyphenyl)carbonyl-phenyl]propanoic acid Openeye Name: 3-[2-isobutoxy-5-(4-propoxybenzoyl)phenyl]propanoic acid CAS Name: 3-[2-(2-methylpropoxy)-5-[oxo-(4-propoxyphenyl)methyl]phenyl]propanoic acid IUPAC Name: 3-[2-(2-methylpropoxy)-5-(4-propoxybenzoyl)phenyl]propanoic acid Traditional Name: 3-[2-isobutoxy-5-(4-propoxybenzoyl)phenyl]propionic acid Formula: C23H28O5 MolecularWeight: 384.46542

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)OCC(C)C)CCC(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)OCC(C)C)CCC(=O)O

InChI

InChI=1S/C23H28O5/c1-4-13-27-20-9-5-17(6-10-20)23(26)19-7-11-21(28-15-16(2)3)18(14-19)8-12-22(24)25/h5-7,9-11,14,16H,4,8,12-13,15H2,1-3H3,(H,24,25)