5-[4-(3-oxidanylidenebutyl)phenyl]hex-5-en-2-one

Systemtic Name: 5-[4-(3-oxidanylidenebutyl)phenyl]hex-5-en-2-one Openeye Name: 5-[4-(3-oxobutyl)phenyl]hex-5-en-2-one CAS Name: 5-[4-(3-oxobutyl)phenyl]-5-hexen-2-one IUPAC Name: 5-[4-(3-oxobutyl)phenyl]hex-5-en-2-one Traditional Name: 5-[4-(3-ketobutyl)phenyl]hex-5-en-2-one Formula: C16H20O2 MolecularWeight: 244.3288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(C=C1)C(=C)CCC(=O)C

Isomeric SMILES

CC(=O)CCC1=CC=C(C=C1)C(=C)CCC(=O)C

InChI

InChI=1S/C16H20O2/c1-12(4-5-13(2)17)16-10-8-15(9-11-16)7-6-14(3)18/h8-11H,1,4-7H2,2-3H3