6-[4-(4-chlorophenyl)-2,5-dimethyl-phenyl]-2,2-dimethyl-5-oxidanylidene-hexanoic acid

Systemtic Name: 6-[4-(4-chlorophenyl)-2,5-dimethyl-phenyl]-2,2-dimethyl-5-oxidanylidene-hexanoic acid Openeye Name: 6-[4-(4-chlorophenyl)-2,5-dimethyl-phenyl]-2,2-dimethyl-5-oxo-hexanoic acid CAS Name: 6-[4-(4-chlorophenyl)-2,5-dimethylphenyl]-2,2-dimethyl-5-oxohexanoic acid IUPAC Name: 6-[4-(4-chlorophenyl)-2,5-dimethylphenyl]-2,2-dimethyl-5-oxohexanoic acid Traditional Name: 6-[4-(4-chlorophenyl)-2,5-dimethyl-phenyl]-5-keto-2,2-dimethyl-hexanoic acid Formula: C22H25ClO3 MolecularWeight: 372.8851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CC=C(C=C2)Cl)C)CC(=O)CCC(C)(C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1C2=CC=C(C=C2)Cl)C)CC(=O)CCC(C)(C)C(=O)O

InChI

InChI=1S/C22H25ClO3/c1-14-12-20(16-5-7-18(23)8-6-16)15(2)11-17(14)13-19(24)9-10-22(3,4)21(25)26/h5-8,11-12H,9-10,13H2,1-4H3,(H,25,26)