(1R,2R,4R,6S)-4,6-dimethyl-5-oxidanylidene-bicyclo[2.2.2]octane-2-carboxylic acid

Systemtic Name: (1R,2R,4R,6S)-4,6-dimethyl-5-oxidanylidene-bicyclo[2.2.2]octane-2-carboxylic acid Openeye Name: (1R,2R,4R,6S)-4,6-dimethyl-5-oxo-bicyclo[2.2.2]octane-2-carboxylic acid CAS Name: (1R,2R,4R,6S)-4,6-dimethyl-5-oxo-2-bicyclo[2.2.2]octanecarboxylic acid IUPAC Name: (1R,2R,4R,6S)-4,6-dimethyl-5-oxobicyclo[2.2.2]octane-2-carboxylic acid Traditional Name: (1R,2R,4R,6S)-5-keto-4,6-dimethyl-bicyclo[2.2.2]octane-2-carboxylic acid Formula: C11H16O3 MolecularWeight: 196.24294

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CCC(C1=O)(CC2C(=O)O)C

Isomeric SMILES

C[C@H]1[C@H]2CC[C@@](C1=O)(C[C@H]2C(=O)O)C

InChI

InChI=1S/C11H16O3/c1-6-7-3-4-11(2,9(6)12)5-8(7)10(13)14/h6-8H,3-5H2,1-2H3,(H,13,14)/t6-,7+,8+,11+/m0/s1