2,3-dimethyl-6-(3-methylbutanoyl)benzoic acid

Systemtic Name: 2,3-dimethyl-6-(3-methylbutanoyl)benzoic acid Openeye Name: 2,3-dimethyl-6-(3-methylbutanoyl)benzoic acid CAS Name: 2,3-dimethyl-6-(3-methyl-1-oxobutyl)benzoic acid IUPAC Name: 2,3-dimethyl-6-(3-methylbutanoyl)benzoic acid Traditional Name: 6-isovaleryl-2,3-dimethyl-benzoic acid Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O3/c1-8(2)7-12(15)11-6-5-9(3)10(4)13(11)14(16)17/h5-6,8H,7H2,1-4H3,(H,16,17)