4-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]butanoic acid

Systemtic Name: 4-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]butanoic acid Openeye Name: 4-[3-(4-chlorobenzoyl)-2-methyl-phenyl]butanoic acid CAS Name: 4-[3-[(4-chlorophenyl)-oxomethyl]-2-methylphenyl]butanoic acid IUPAC Name: 4-[3-(4-chlorobenzoyl)-2-methylphenyl]butanoic acid Traditional Name: 4-[3-(4-chlorobenzoyl)-2-methyl-phenyl]butyric acid Formula: C18H17ClO3 MolecularWeight: 316.77878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1CCCC(=O)O)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C=CC=C1CCCC(=O)O)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H17ClO3/c1-12-13(5-3-7-17(20)21)4-2-6-16(12)18(22)14-8-10-15(19)11-9-14/h2,4,6,8-11H,3,5,7H2,1H3,(H,20,21)