6-(4-chloranylphenoxy)-2,2-dimethyl-hexanoic acid

Systemtic Name: 6-(4-chloranylphenoxy)-2,2-dimethyl-hexanoic acid Openeye Name: 6-(4-chlorophenoxy)-2,2-dimethyl-hexanoic acid CAS Name: 6-(4-chlorophenoxy)-2,2-dimethylhexanoic acid IUPAC Name: 6-(4-chlorophenoxy)-2,2-dimethylhexanoic acid Traditional Name: 6-(4-chlorophenoxy)-2,2-dimethyl-hexanoic acid Formula: C14H19ClO3 MolecularWeight: 270.75186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCOC1=CC=C(C=C1)Cl)C(=O)O

Isomeric SMILES

CC(C)(CCCCOC1=CC=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C14H19ClO3/c1-14(2,13(16)17)9-3-4-10-18-12-7-5-11(15)6-8-12/h5-8H,3-4,9-10H2,1-2H3,(H,16,17)