4-[3-chloranyl-4-(3,3-dimethyl-4-oxidanyl-4-oxidanylidene-butoxy)phenoxy]-2,2-dimethyl-butanoic acid

Systemtic Name: 4-[3-chloranyl-4-(3,3-dimethyl-4-oxidanyl-4-oxidanylidene-butoxy)phenoxy]-2,2-dimethyl-butanoic acid Openeye Name: 4-[3-chloro-4-(4-hydroxy-3,3-dimethyl-4-oxo-butoxy)phenoxy]-2,2-dimethyl-butanoic acid CAS Name: 4-[3-chloro-4-(4-hydroxy-3,3-dimethyl-4-oxobutoxy)phenoxy]-2,2-dimethylbutanoic acid IUPAC Name: 4-[3-chloro-4-(4-hydroxy-3,3-dimethyl-4-oxobutoxy)phenoxy]-2,2-dimethylbutanoic acid Traditional Name: 4-[3-chloro-4-(4-hydroxy-4-keto-3,3-dimethyl-butoxy)phenoxy]-2,2-dimethyl-butyric acid Formula: C18H25ClO6 MolecularWeight: 372.8405

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCOC1=CC(=C(C=C1)OCCC(C)(C)C(=O)O)Cl)C(=O)O

Isomeric SMILES

CC(C)(CCOC1=CC(=C(C=C1)OCCC(C)(C)C(=O)O)Cl)C(=O)O

InChI

InChI=1S/C18H25ClO6/c1-17(2,15(20)21)7-9-24-12-5-6-14(13(19)11-12)25-10-8-18(3,4)16(22)23/h5-6,11H,7-10H2,1-4H3,(H,20,21)(H,22,23)