4-(4-chloranyl-3-methyl-phenyl)-2,2-dimethyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-chloranyl-3-methyl-phenyl)-2,2-dimethyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-chloro-3-methyl-phenyl)-2,2-dimethyl-4-oxo-butanoic acid CAS Name: 4-(4-chloro-3-methylphenyl)-2,2-dimethyl-4-oxobutanoic acid IUPAC Name: 4-(4-chloro-3-methylphenyl)-2,2-dimethyl-4-oxobutanoic acid Traditional Name: 4-(4-chloro-3-methyl-phenyl)-4-keto-2,2-dimethyl-butyric acid Formula: C13H15ClO3 MolecularWeight: 254.7094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)CC(C)(C)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)CC(C)(C)C(=O)O)Cl

InChI

InChI=1S/C13H15ClO3/c1-8-6-9(4-5-10(8)14)11(15)7-13(2,3)12(16)17/h4-6H,7H2,1-3H3,(H,16,17)