hept-6-enyl benzoate

Systemtic Name: hept-6-enyl benzoate Openeye Name: hept-6-enyl benzoate CAS Name: benzoic acid hept-6-enyl ester IUPAC Name: hept-6-enyl benzoate Traditional Name: benzoic acid hept-6-enyl ester Formula: C14H18O2 MolecularWeight: 218.29152

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCOC(=O)C1=CC=CC=C1

Isomeric SMILES

C=CCCCCCOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H18O2/c1-2-3-4-5-9-12-16-14(15)13-10-7-6-8-11-13/h2,6-8,10-11H,1,3-5,9,12H2