(5S,6R)-3-tert-butyl-5,6-dimethyl-cyclohex-2-en-1-one

Systemtic Name: (5S,6R)-3-tert-butyl-5,6-dimethyl-cyclohex-2-en-1-one Openeye Name: (5S,6R)-3-tert-butyl-5,6-dimethyl-cyclohex-2-en-1-one CAS Name: (5S,6R)-3-tert-butyl-5,6-dimethyl-1-cyclohex-2-enone IUPAC Name: (5S,6R)-3-tert-butyl-5,6-dimethylcyclohex-2-en-1-one Traditional Name: (5S,6R)-3-tert-butyl-5,6-dimethyl-cyclohex-2-en-1-one Formula: C12H20O MolecularWeight: 180.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC(=O)C1C)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C12H20O/c1-8-6-10(12(3,4)5)7-11(13)9(8)2/h7-9H,6H2,1-5H3/t8-,9+/m0/s1