3-chloranyl-4-(2-chloranyl-3-methyl-butanoyl)oxy-benzoic acid

Systemtic Name: 3-chloranyl-4-(2-chloranyl-3-methyl-butanoyl)oxy-benzoic acid Openeye Name: 3-chloro-4-(2-chloro-3-methyl-butanoyl)oxy-benzoic acid CAS Name: 3-chloro-4-(2-chloro-3-methyl-1-oxobutoxy)benzoic acid IUPAC Name: 3-chloro-4-(2-chloro-3-methylbutanoyl)oxybenzoic acid Traditional Name: 3-chloro-4-(2-chloro-3-methyl-butanoyl)oxy-benzoic acid Formula: C12H12Cl2O4 MolecularWeight: 291.12728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC1=C(C=C(C=C1)C(=O)O)Cl)Cl

Isomeric SMILES

CC(C)C(C(=O)OC1=C(C=C(C=C1)C(=O)O)Cl)Cl

InChI

InChI=1S/C12H12Cl2O4/c1-6(2)10(14)12(17)18-9-4-3-7(11(15)16)5-8(9)13/h3-6,10H,1-2H3,(H,15,16)