(1R,4S,5R)-2,2,4-trimethyl-3-oxidanylidene-bicyclo[2.2.2]octane-5-carboxylic acid

Systemtic Name: (1R,4S,5R)-2,2,4-trimethyl-3-oxidanylidene-bicyclo[2.2.2]octane-5-carboxylic acid Openeye Name: (1R,4S,5R)-2,2,4-trimethyl-3-oxo-bicyclo[2.2.2]octane-5-carboxylic acid CAS Name: (1R,4S,5R)-2,2,4-trimethyl-3-oxo-5-bicyclo[2.2.2]octanecarboxylic acid IUPAC Name: (1R,4S,5R)-2,2,4-trimethyl-3-oxobicyclo[2.2.2]octane-5-carboxylic acid Traditional Name: (1R,4S,5R)-3-keto-2,2,4-trimethyl-bicyclo[2.2.2]octane-5-carboxylic acid Formula: C12H18O3 MolecularWeight: 210.26952

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC(C1=O)(C(C2)C(=O)O)C)C

Isomeric SMILES

C[C@]12CC[C@H](C[C@H]1C(=O)O)C(C2=O)(C)C

InChI

InChI=1S/C12H18O3/c1-11(2)7-4-5-12(3,10(11)15)8(6-7)9(13)14/h7-8H,4-6H2,1-3H3,(H,13,14)/t7-,8+,12+/m1/s1