6-[4-(4-chlorophenyl)carbonylphenoxy]-2,2-dimethyl-hexanoic acid

Systemtic Name: 6-[4-(4-chlorophenyl)carbonylphenoxy]-2,2-dimethyl-hexanoic acid Openeye Name: 6-[4-(4-chlorobenzoyl)phenoxy]-2,2-dimethyl-hexanoic acid CAS Name: 6-[4-[(4-chlorophenyl)-oxomethyl]phenoxy]-2,2-dimethylhexanoic acid IUPAC Name: 6-[4-(4-chlorobenzoyl)phenoxy]-2,2-dimethylhexanoic acid Traditional Name: 6-[4-(4-chlorobenzoyl)phenoxy]-2,2-dimethyl-hexanoic acid Formula: C21H23ClO4 MolecularWeight: 374.85792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCOC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC(C)(CCCCOC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C21H23ClO4/c1-21(2,20(24)25)13-3-4-14-26-18-11-7-16(8-12-18)19(23)15-5-9-17(22)10-6-15/h5-12H,3-4,13-14H2,1-2H3,(H,24,25)