[(E)-undec-6-en-4-ynyl] benzoate

Systemtic Name: [(E)-undec-6-en-4-ynyl] benzoate Openeye Name: [(E)-undec-6-en-4-ynyl] benzoate CAS Name: benzoic acid [(E)-undec-6-en-4-ynyl] ester IUPAC Name: [(E)-undec-6-en-4-ynyl] benzoate Traditional Name: benzoic acid [(E)-undec-6-en-4-ynyl] ester Formula: C18H22O2 MolecularWeight: 270.36608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC#CCCCOC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCC/C=C/C#CCCCOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C18H22O2/c1-2-3-4-5-6-7-8-9-13-16-20-18(19)17-14-11-10-12-15-17/h5-6,10-12,14-15H,2-4,9,13,16H2,1H3/b6-5+