2,2,4-trimethyl-5-oxidanylidene-cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 2,2,4-trimethyl-5-oxidanylidene-cyclohex-3-ene-1-carboxylic acid Openeye Name: 2,2,4-trimethyl-5-oxo-cyclohex-3-ene-1-carboxylic acid CAS Name: 2,2,4-trimethyl-5-oxo-1-cyclohex-3-enecarboxylic acid IUPAC Name: 2,2,4-trimethyl-5-oxocyclohex-3-ene-1-carboxylic acid Traditional Name: 5-keto-2,2,4-trimethyl-cyclohex-3-ene-1-carboxylic acid Formula: C10H14O3 MolecularWeight: 182.21636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O3/c1-6-5-10(2,3)7(9(12)13)4-8(6)11/h5,7H,4H2,1-3H3,(H,12,13)