4-[2-(3-oxidanylidenebut-1-ynyl)phenyl]but-3-yn-2-one

Systemtic Name: 4-[2-(3-oxidanylidenebut-1-ynyl)phenyl]but-3-yn-2-one Openeye Name: 4-[2-(3-oxobut-1-ynyl)phenyl]but-3-yn-2-one CAS Name: 4-[2-(3-oxobut-1-ynyl)phenyl]-3-butyn-2-one IUPAC Name: 4-[2-(3-oxobut-1-ynyl)phenyl]but-3-yn-2-one Traditional Name: 4-[2-(3-ketobut-1-ynyl)phenyl]but-3-yn-2-one Formula: C14H10O2 MolecularWeight: 210.228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C#CC1=CC=CC=C1C#CC(=O)C

Isomeric SMILES

CC(=O)C#CC1=CC=CC=C1C#CC(=O)C

InChI

InChI=1S/C14H10O2/c1-11(15)7-9-13-5-3-4-6-14(13)10-8-12(2)16/h3-6H,1-2H3