methyl 6-[4-(4-chlorophenyl)-2,5-dimethyl-phenyl]-2,2-dimethyl-5-oxidanylidene-hexanoate

Systemtic Name: methyl 6-[4-(4-chlorophenyl)-2,5-dimethyl-phenyl]-2,2-dimethyl-5-oxidanylidene-hexanoate Openeye Name: methyl 6-[4-(4-chlorophenyl)-2,5-dimethyl-phenyl]-2,2-dimethyl-5-oxo-hexanoate CAS Name: 6-[4-(4-chlorophenyl)-2,5-dimethylphenyl]-2,2-dimethyl-5-oxohexanoic acid methyl ester IUPAC Name: methyl 6-[4-(4-chlorophenyl)-2,5-dimethylphenyl]-2,2-dimethyl-5-oxohexanoate Traditional Name: 6-[4-(4-chlorophenyl)-2,5-dimethyl-phenyl]-5-keto-2,2-dimethyl-hexanoic acid methyl ester Formula: C23H27ClO3 MolecularWeight: 386.91168

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H27ClO3/c1-15-13-21(17-6-8-19(24)9-7-17)16(2)12-18(15)14-20(25)10-11-23(3,4)22(26)27-5/h6-9,12-13H,10-11,14H2,1-5H3