hex-5-ynyl benzoate

Systemtic Name: hex-5-ynyl benzoate Openeye Name: hex-5-ynyl benzoate CAS Name: benzoic acid hex-5-ynyl ester IUPAC Name: hex-5-ynyl benzoate Traditional Name: benzoic acid hex-5-ynyl ester Formula: C13H14O2 MolecularWeight: 202.24906

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCCOC(=O)C1=CC=CC=C1

Isomeric SMILES

C#CCCCCOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H14O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h1,5-7,9-10H,3-4,8,11H2