7-(6-oxidanylidenepyran-2-yl)hepta-4,6-diynyl ethanoate

Systemtic Name: 7-(6-oxidanylidenepyran-2-yl)hepta-4,6-diynyl ethanoate Openeye Name: 7-(6-oxopyran-2-yl)hepta-4,6-diynyl acetate CAS Name: acetic acid 7-(6-oxo-2-pyranyl)hepta-4,6-diynyl ester IUPAC Name: 7-(6-oxopyran-2-yl)hepta-4,6-diynyl acetate Traditional Name: acetic acid 7-(6-ketopyran-2-yl)hepta-4,6-diynyl ester Formula: C14H12O4 MolecularWeight: 244.24268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCC#CC#CC1=CC=CC(=O)O1

Isomeric SMILES

CC(=O)OCCCC#CC#CC1=CC=CC(=O)O1

InChI

InChI=1S/C14H12O4/c1-12(15)17-11-6-4-2-3-5-8-13-9-7-10-14(16)18-13/h7,9-10H,4,6,11H2,1H3