2-[4-[3-[4-ethyl-2-(phenylcarbonyl)phenoxy]butoxy]-2-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3-[4-ethyl-2-(phenylcarbonyl)phenoxy]butoxy]-2-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[3-(2-benzoyl-4-ethyl-phenoxy)butoxy]-2-methyl-phenoxy]acetic acid CAS Name: 2-[4-[3-(2-benzoyl-4-ethylphenoxy)butoxy]-2-methylphenoxy]acetic acid IUPAC Name: 2-[4-[3-(2-benzoyl-4-ethylphenoxy)butoxy]-2-methylphenoxy]acetic acid Traditional Name: 2-[4-[3-(2-benzoyl-4-ethyl-phenoxy)butoxy]-2-methyl-phenoxy]acetic acid Formula: C28H30O6 MolecularWeight: 462.5342

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC(C)CCOC2=CC(=C(C=C2)OCC(=O)O)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=C(C=C1)OC(C)CCOC2=CC(=C(C=C2)OCC(=O)O)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H30O6/c1-4-21-10-12-26(24(17-21)28(31)22-8-6-5-7-9-22)34-20(3)14-15-32-23-11-13-25(19(2)16-23)33-18-27(29)30/h5-13,16-17,20H,4,14-15,18H2,1-3H3,(H,29,30)