3-[4-[3-(2-cyclopropylcarbonyl-4-ethyl-phenoxy)butoxy]phenyl]-2,2-dimethyl-propanoic acid

Systemtic Name: 3-[4-[3-(2-cyclopropylcarbonyl-4-ethyl-phenoxy)butoxy]phenyl]-2,2-dimethyl-propanoic acid Openeye Name: 3-[4-[3-[2-(cyclopropanecarbonyl)-4-ethyl-phenoxy]butoxy]phenyl]-2,2-dimethyl-propanoic acid CAS Name: 3-[4-[3-[2-[cyclopropyl(oxo)methyl]-4-ethylphenoxy]butoxy]phenyl]-2,2-dimethylpropanoic acid IUPAC Name: 3-[4-[3-[2-(cyclopropanecarbonyl)-4-ethylphenoxy]butoxy]phenyl]-2,2-dimethylpropanoic acid Traditional Name: 3-[4-[3-[2-(cyclopropanecarbonyl)-4-ethyl-phenoxy]butoxy]phenyl]-2,2-dimethyl-propionic acid Formula: C27H34O5 MolecularWeight: 438.55586

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OC(C)CCOC2=CC=C(C=C2)CC(C)(C)C(=O)O)C(=O)C3CC3

Isomeric SMILES

CCC1=CC(=C(C=C1)OC(C)CCOC2=CC=C(C=C2)CC(C)(C)C(=O)O)C(=O)C3CC3

InChI

InChI=1S/C27H34O5/c1-5-19-8-13-24(23(16-19)25(28)21-9-10-21)32-18(2)14-15-31-22-11-6-20(7-12-22)17-27(3,4)26(29)30/h6-8,11-13,16,18,21H,5,9-10,14-15,17H2,1-4H3,(H,29,30)