2-(3-tert-butylphenoxy)-2-[4-[(4-chloranylphenoxy)methoxy]phenyl]propanoic acid

Systemtic Name: 2-(3-tert-butylphenoxy)-2-[4-[(4-chloranylphenoxy)methoxy]phenyl]propanoic acid Openeye Name: 2-(3-tert-butylphenoxy)-2-[4-[(4-chlorophenoxy)methoxy]phenyl]propanoic acid CAS Name: 2-(3-tert-butylphenoxy)-2-[4-[(4-chlorophenoxy)methoxy]phenyl]propanoic acid IUPAC Name: 2-(3-tert-butylphenoxy)-2-[4-[(4-chlorophenoxy)methoxy]phenyl]propanoic acid Traditional Name: 2-(3-tert-butylphenoxy)-2-[4-[(4-chlorophenoxy)methoxy]phenyl]propionic acid Formula: C26H27ClO5 MolecularWeight: 454.94258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC=C1)OC(C)(C2=CC=C(C=C2)OCOC3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC=C1)OC(C)(C2=CC=C(C=C2)OCOC3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C26H27ClO5/c1-25(2,3)19-6-5-7-23(16-19)32-26(4,24(28)29)18-8-12-21(13-9-18)30-17-31-22-14-10-20(27)11-15-22/h5-16H,17H2,1-4H3,(H,28,29)