(3R)-1-(3,5-dibutyl-4-oxidanyl-phenyl)-3-methyl-hex-5-yn-1-one

Systemtic Name: (3R)-1-(3,5-dibutyl-4-oxidanyl-phenyl)-3-methyl-hex-5-yn-1-one Openeye Name: (3R)-1-(3,5-dibutyl-4-hydroxy-phenyl)-3-methyl-hex-5-yn-1-one CAS Name: (3R)-1-(3,5-dibutyl-4-hydroxyphenyl)-3-methyl-5-hexyn-1-one IUPAC Name: (3R)-1-(3,5-dibutyl-4-hydroxyphenyl)-3-methylhex-5-yn-1-one Traditional Name: (3R)-1-(3,5-dibutyl-4-hydroxy-phenyl)-3-methyl-hex-5-yn-1-one Formula: C21H30O2 MolecularWeight: 314.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC(=C1O)CCCC)C(=O)CC(C)CC#C

Isomeric SMILES

CCCCC1=CC(=CC(=C1O)CCCC)C(=O)C[C@H](C)CC#C

InChI

InChI=1S/C21H30O2/c1-5-8-11-17-14-19(20(22)13-16(4)10-7-3)15-18(21(17)23)12-9-6-2/h3,14-16,23H,5-6,8-13H2,1-2,4H3/t16-/m1/s1