6-(2,5-dimethylphenyl)-3,3-dimethyl-5-oxidanylidene-hexanoic acid

Systemtic Name: 6-(2,5-dimethylphenyl)-3,3-dimethyl-5-oxidanylidene-hexanoic acid Openeye Name: 6-(2,5-dimethylphenyl)-3,3-dimethyl-5-oxo-hexanoic acid CAS Name: 6-(2,5-dimethylphenyl)-3,3-dimethyl-5-oxohexanoic acid IUPAC Name: 6-(2,5-dimethylphenyl)-3,3-dimethyl-5-oxohexanoic acid Traditional Name: 6-(2,5-dimethylphenyl)-5-keto-3,3-dimethyl-hexanoic acid Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O3/c1-11-5-6-12(2)13(7-11)8-14(17)9-16(3,4)10-15(18)19/h5-7H,8-10H2,1-4H3,(H,18,19)