1-(2,4-ditert-butyl-3-oxidanyl-phenyl)hex-5-yn-1-one

Systemtic Name: 1-(2,4-ditert-butyl-3-oxidanyl-phenyl)hex-5-yn-1-one Openeye Name: 1-(2,4-ditert-butyl-3-hydroxy-phenyl)hex-5-yn-1-one CAS Name: 1-(2,4-ditert-butyl-3-hydroxyphenyl)-5-hexyn-1-one IUPAC Name: 1-(2,4-ditert-butyl-3-hydroxyphenyl)hex-5-yn-1-one Traditional Name: 1-(2,4-ditert-butyl-3-hydroxy-phenyl)hex-5-yn-1-one Formula: C20H28O2 MolecularWeight: 300.43512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C(C=C1)C(=O)CCCC#C)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=C(C(=C(C=C1)C(=O)CCCC#C)C(C)(C)C)O

InChI

InChI=1S/C20H28O2/c1-8-9-10-11-16(21)14-12-13-15(19(2,3)4)18(22)17(14)20(5,6)7/h1,12-13,22H,9-11H2,2-7H3