(2S,3R)-3-but-3-enyl-2-hexyl-2-(2-phenylethynyl)oxirane

Systemtic Name: (2S,3R)-3-but-3-enyl-2-hexyl-2-(2-phenylethynyl)oxirane Openeye Name: (2S,3R)-3-but-3-enyl-2-hexyl-2-(2-phenylethynyl)oxirane CAS Name: (2S,3R)-3-but-3-enyl-2-hexyl-2-(2-phenylethynyl)oxirane IUPAC Name: (2S,3R)-3-but-3-enyl-2-hexyl-2-(2-phenylethynyl)oxirane Traditional Name: (2S,3R)-3-but-3-enyl-2-hexyl-2-(2-phenylethynyl)oxirane Formula: C20H26O MolecularWeight: 282.41984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C(O1)CCC=C)C#CC2=CC=CC=C2

Isomeric SMILES

CCCCCC[C@@]1([C@H](O1)CCC=C)C#CC2=CC=CC=C2

InChI

InChI=1S/C20H26O/c1-3-5-7-11-16-20(19(21-20)14-6-4-2)17-15-18-12-9-8-10-13-18/h4,8-10,12-13,19H,2-3,5-7,11,14,16H2,1H3/t19-,20+/m1/s1