2-[2-(chloromethyl)-3,4,5,6-tetramethyl-phenyl]ethanoic acid

Systemtic Name: 2-[2-(chloromethyl)-3,4,5,6-tetramethyl-phenyl]ethanoic acid Openeye Name: 2-[2-(chloromethyl)-3,4,5,6-tetramethyl-phenyl]acetic acid CAS Name: 2-[2-(chloromethyl)-3,4,5,6-tetramethylphenyl]acetic acid IUPAC Name: 2-[2-(chloromethyl)-3,4,5,6-tetramethylphenyl]acetic acid Traditional Name: 2-[2-(chloromethyl)-3,4,5,6-tetramethyl-phenyl]acetic acid Formula: C13H17ClO2 MolecularWeight: 240.72588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17ClO2/c1-7-8(2)10(4)12(6-14)11(9(7)3)5-13(15)16/h5-6H2,1-4H3,(H,15,16)