(4S)-4-tert-butyl-2-(1-oxidanyl-3-phenyl-prop-2-ynylidene)cyclohexan-1-one

Systemtic Name: (4S)-4-tert-butyl-2-(1-oxidanyl-3-phenyl-prop-2-ynylidene)cyclohexan-1-one Openeye Name: (4S)-4-tert-butyl-2-(1-hydroxy-3-phenyl-prop-2-ynylidene)cyclohexanone CAS Name: (4S)-4-tert-butyl-2-(1-hydroxy-3-phenylprop-2-ynylidene)-1-cyclohexanone IUPAC Name: (4S)-4-tert-butyl-2-(1-hydroxy-3-phenylprop-2-ynylidene)cyclohexan-1-one Traditional Name: (4S)-4-tert-butyl-2-(1-hydroxy-3-phenyl-prop-2-ynylidene)cyclohexanone Formula: C19H22O2 MolecularWeight: 282.37678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(=O)C(=C(C#CC2=CC=CC=C2)O)C1

Isomeric SMILES

CC(C)(C)[C@H]1CCC(=O)C(=C(C#CC2=CC=CC=C2)O)C1

InChI

InChI=1S/C19H22O2/c1-19(2,3)15-10-12-18(21)16(13-15)17(20)11-9-14-7-5-4-6-8-14/h4-8,15,20H,10,12-13H2,1-3H3/t15-/m0/s1