(1S,3R,5S,6S)-6-tert-butyl-9-oxidanylidene-bicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: (1S,3R,5S,6S)-6-tert-butyl-9-oxidanylidene-bicyclo[3.3.1]nonane-3-carboxylate Openeye Name: (1S,3R,5S,6S)-6-tert-butyl-9-oxo-bicyclo[3.3.1]nonane-3-carboxylate CAS Name: (1S,3R,5S,6S)-6-tert-butyl-9-oxo-3-bicyclo[3.3.1]nonanecarboxylate IUPAC Name: (1S,3R,5S,6S)-6-tert-butyl-9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: (1S,3R,5S,6S)-6-tert-butyl-9-keto-bicyclo[3.3.1]nonane-3-carboxylate Formula: C14H21O3- MolecularWeight: 237.31474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2CC(CC1C2=O)C(=O)[O-]

Isomeric SMILES

CC(C)(C)[C@H]1CC[C@H]2C[C@H](C[C@@H]1C2=O)C(=O)[O-]

InChI

InChI=1S/C14H22O3/c1-14(2,3)11-5-4-8-6-9(13(16)17)7-10(11)12(8)15/h8-11H,4-7H2,1-3H3,(H,16,17)/p-1/t8-,9+,10-,11-/m0/s1