2-[4-(4-chloranylbutanoyl)-2,3-dimethyl-phenyl]ethanoic acid

Systemtic Name: 2-[4-(4-chloranylbutanoyl)-2,3-dimethyl-phenyl]ethanoic acid Openeye Name: 2-[4-(4-chlorobutanoyl)-2,3-dimethyl-phenyl]acetic acid CAS Name: 2-[4-(4-chloro-1-oxobutyl)-2,3-dimethylphenyl]acetic acid IUPAC Name: 2-[4-(4-chlorobutanoyl)-2,3-dimethylphenyl]acetic acid Traditional Name: 2-[4-(4-chlorobutanoyl)-2,3-dimethyl-phenyl]acetic acid Formula: C14H17ClO3 MolecularWeight: 268.73598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)C(=O)CCCCl)CC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1C)C(=O)CCCCl)CC(=O)O

InChI

InChI=1S/C14H17ClO3/c1-9-10(2)12(13(16)4-3-7-15)6-5-11(9)8-14(17)18/h5-6H,3-4,7-8H2,1-2H3,(H,17,18)