4-[(4S,5S)-2,2-dimethyl-5-(4-oxidanylidenebut-2-ynyl)-1,3-dioxolan-4-yl]but-2-ynal

Systemtic Name: 4-[(4S,5S)-2,2-dimethyl-5-(4-oxidanylidenebut-2-ynyl)-1,3-dioxolan-4-yl]but-2-ynal Openeye Name: 4-[(4S,5S)-2,2-dimethyl-5-(4-oxobut-2-ynyl)-1,3-dioxolan-4-yl]but-2-ynal CAS Name: 4-[(4S,5S)-2,2-dimethyl-5-(4-oxobut-2-ynyl)-1,3-dioxolan-4-yl]-2-butynal IUPAC Name: 4-[(4S,5S)-2,2-dimethyl-5-(4-oxobut-2-ynyl)-1,3-dioxolan-4-yl]but-2-ynal Traditional Name: 4-[(4S,5S)-5-(4-ketobut-2-ynyl)-2,2-dimethyl-1,3-dioxolan-4-yl]but-2-ynal Formula: C13H14O4 MolecularWeight: 234.24786

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(C(O1)CC#CC=O)CC#CC=O)C

Isomeric SMILES

CC1(O[C@H]([C@@H](O1)CC#CC=O)CC#CC=O)C

InChI

InChI=1S/C13H14O4/c1-13(2)16-11(7-3-5-9-14)12(17-13)8-4-6-10-15/h9-12H,7-8H2,1-2H3/t11-,12-/m0/s1