3-chloranyl-2-methyl-6-oxidanyl-5-propan-2-yl-benzoate

Systemtic Name: 3-chloranyl-2-methyl-6-oxidanyl-5-propan-2-yl-benzoate Openeye Name: 5-chloro-2-hydroxy-3-isopropyl-6-methyl-benzoate CAS Name: 5-chloro-2-hydroxy-6-methyl-3-propan-2-ylbenzoate IUPAC Name: 5-chloro-2-hydroxy-6-methyl-3-propan-2-ylbenzoate Traditional Name: 5-chloro-2-hydroxy-3-isopropyl-6-methyl-benzoate Formula: C11H12ClO3- MolecularWeight: 227.66418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1C(=O)[O-])O)C(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C(=C1C(=O)[O-])O)C(C)C)Cl

InChI

InChI=1S/C11H13ClO3/c1-5(2)7-4-8(12)6(3)9(10(7)13)11(14)15/h4-5,13H,1-3H3,(H,14,15)/p-1