(E)-6-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]hex-5-enoic acid

Systemtic Name: (E)-6-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]hex-5-enoic acid Openeye Name: (E)-6-[3-(4-chlorobenzoyl)-2-methyl-phenyl]hex-5-enoic acid CAS Name: (E)-6-[3-[(4-chlorophenyl)-oxomethyl]-2-methylphenyl]-5-hexenoic acid IUPAC Name: (E)-6-[3-(4-chlorobenzoyl)-2-methylphenyl]hex-5-enoic acid Traditional Name: (E)-6-[3-(4-chlorobenzoyl)-2-methyl-phenyl]hex-5-enoic acid Formula: C20H19ClO3 MolecularWeight: 342.81606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1C(=O)C2=CC=C(C=C2)Cl)C=CCCCC(=O)O

Isomeric SMILES

CC1=C(C=CC=C1C(=O)C2=CC=C(C=C2)Cl)/C=C/CCCC(=O)O

InChI

InChI=1S/C20H19ClO3/c1-14-15(6-3-2-4-9-19(22)23)7-5-8-18(14)20(24)16-10-12-17(21)13-11-16/h3,5-8,10-13H,2,4,9H2,1H3,(H,22,23)/b6-3+