4-[2-(3-bromanylprop-1-ynyl)phenyl]butan-2-one

Systemtic Name: 4-[2-(3-bromanylprop-1-ynyl)phenyl]butan-2-one Openeye Name: 4-[2-(3-bromoprop-1-ynyl)phenyl]butan-2-one CAS Name: 4-[2-(3-bromoprop-1-ynyl)phenyl]-2-butanone IUPAC Name: 4-[2-(3-bromoprop-1-ynyl)phenyl]butan-2-one Traditional Name: 4-[2-(3-bromoprop-1-ynyl)phenyl]butan-2-one Formula: C13H13BrO MolecularWeight: 265.14572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=CC=C1C#CCBr

Isomeric SMILES

CC(=O)CCC1=CC=CC=C1C#CCBr

InChI

InChI=1S/C13H13BrO/c1-11(15)8-9-13-6-3-2-5-12(13)7-4-10-14/h2-3,5-6H,8-10H2,1H3