3-[4-(4-chlorophenyl)phenyl]carbonyl-5-methyl-hexanoic acid

Systemtic Name: 3-[4-(4-chlorophenyl)phenyl]carbonyl-5-methyl-hexanoic acid Openeye Name: 3-[4-(4-chlorophenyl)benzoyl]-5-methyl-hexanoic acid CAS Name: 3-[[4-(4-chlorophenyl)phenyl]-oxomethyl]-5-methylhexanoic acid IUPAC Name: 3-[4-(4-chlorophenyl)benzoyl]-5-methylhexanoic acid Traditional Name: 3-[4-(4-chlorophenyl)benzoyl]-5-methyl-hexanoic acid Formula: C20H21ClO3 MolecularWeight: 344.83194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClO3/c1-13(2)11-17(12-19(22)23)20(24)16-5-3-14(4-6-16)15-7-9-18(21)10-8-15/h3-10,13,17H,11-12H2,1-2H3,(H,22,23)