2-[4-[3-[4-butyl-2-(phenylcarbonyl)phenoxy]butoxy]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[3-[4-butyl-2-(phenylcarbonyl)phenoxy]butoxy]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[3-(2-benzoyl-4-butyl-phenoxy)butoxy]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[3-(2-benzoyl-4-butylphenoxy)butoxy]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[3-(2-benzoyl-4-butylphenoxy)butoxy]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[3-(2-benzoyl-4-butyl-phenoxy)butoxy]phenoxy]-2-methyl-propionic acid Formula: C31H36O6 MolecularWeight: 504.61394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)OC(C)CCOC2=CC=C(C=C2)OC(C)(C)C(=O)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC(=C(C=C1)OC(C)CCOC2=CC=C(C=C2)OC(C)(C)C(=O)O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C31H36O6/c1-5-6-10-23-13-18-28(27(21-23)29(32)24-11-8-7-9-12-24)36-22(2)19-20-35-25-14-16-26(17-15-25)37-31(3,4)30(33)34/h7-9,11-18,21-22H,5-6,10,19-20H2,1-4H3,(H,33,34)