2,6,6-trimethyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylic acid

Systemtic Name: 2,6,6-trimethyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylic acid Openeye Name: 2,6,6-trimethyl-4-oxo-cyclohex-2-ene-1-carboxylic acid CAS Name: 2,6,6-trimethyl-4-oxo-1-cyclohex-2-enecarboxylic acid IUPAC Name: 2,6,6-trimethyl-4-oxocyclohex-2-ene-1-carboxylic acid Traditional Name: 4-keto-2,6,6-trimethyl-cyclohex-2-ene-1-carboxylic acid Formula: C10H14O3 MolecularWeight: 182.21636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O3/c1-6-4-7(11)5-10(2,3)8(6)9(12)13/h4,8H,5H2,1-3H3,(H,12,13)