4-[[4-[(3,3-dimethyl-4-oxidanylidene-4-phenylmethoxy-butoxy)methyl]phenyl]methoxy]-2,2-dimethyl-butanoic acid

Systemtic Name: 4-[[4-[(3,3-dimethyl-4-oxidanylidene-4-phenylmethoxy-butoxy)methyl]phenyl]methoxy]-2,2-dimethyl-butanoic acid Openeye Name: 4-[[4-[(4-benzyloxy-3,3-dimethyl-4-oxo-butoxy)methyl]phenyl]methoxy]-2,2-dimethyl-butanoic acid CAS Name: 4-[[4-[(3,3-dimethyl-4-oxo-4-phenylmethoxybutoxy)methyl]phenyl]methoxy]-2,2-dimethylbutanoic acid IUPAC Name: 4-[[4-[(3,3-dimethyl-4-oxo-4-phenylmethoxybutoxy)methyl]phenyl]methoxy]-2,2-dimethylbutanoic acid Traditional Name: 4-[4-[(4-benzoxy-4-keto-3,3-dimethyl-butoxy)methyl]benzyl]oxy-2,2-dimethyl-butyric acid Formula: C27H36O6 MolecularWeight: 456.57114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCOCC1=CC=C(C=C1)COCCC(C)(C)C(=O)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(CCOCC1=CC=C(C=C1)COCCC(C)(C)C(=O)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C27H36O6/c1-26(2,24(28)29)14-16-31-18-22-10-12-23(13-11-22)19-32-17-15-27(3,4)25(30)33-20-21-8-6-5-7-9-21/h5-13H,14-20H2,1-4H3,(H,28,29)