1-[(1S,4S)-4-tert-butyl-2-methylidene-cyclohexyl]butan-2-one

Systemtic Name: 1-[(1S,4S)-4-tert-butyl-2-methylidene-cyclohexyl]butan-2-one Openeye Name: 1-[(1S,4S)-4-tert-butyl-2-methylene-cyclohexyl]butan-2-one CAS Name: 1-[(1S,4S)-4-tert-butyl-2-methylenecyclohexyl]-2-butanone IUPAC Name: 1-[(1S,4S)-4-tert-butyl-2-methylidenecyclohexyl]butan-2-one Traditional Name: 1-[(1S,4S)-4-tert-butyl-2-methylene-cyclohexyl]butan-2-one Formula: C15H26O MolecularWeight: 222.36634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC1CCC(CC1=C)C(C)(C)C

Isomeric SMILES

CCC(=O)C[C@@H]1CC[C@@H](CC1=C)C(C)(C)C

InChI

InChI=1S/C15H26O/c1-6-14(16)10-12-7-8-13(9-11(12)2)15(3,4)5/h12-13H,2,6-10H2,1,3-5H3/t12-,13-/m0/s1