1-(3,5-ditert-butyl-4-oxidanyl-phenyl)oct-7-yn-1-one

Systemtic Name: 1-(3,5-ditert-butyl-4-oxidanyl-phenyl)oct-7-yn-1-one Openeye Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)oct-7-yn-1-one CAS Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-7-octyn-1-one IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)oct-7-yn-1-one Traditional Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)oct-7-yn-1-one Formula: C22H32O2 MolecularWeight: 328.48828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CCCCCC#C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CCCCCC#C

InChI

InChI=1S/C22H32O2/c1-8-9-10-11-12-13-19(23)16-14-17(21(2,3)4)20(24)18(15-16)22(5,6)7/h1,14-15,24H,9-13H2,2-7H3