hept-1-en-2-yl benzoate

Systemtic Name: hept-1-en-2-yl benzoate Openeye Name: 1-methylenehexyl benzoate CAS Name: benzoic acid hept-1-en-2-yl ester IUPAC Name: hept-1-en-2-yl benzoate Traditional Name: benzoic acid 1-amylvinyl ester Formula: C14H18O2 MolecularWeight: 218.29152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=C)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCC(=C)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H18O2/c1-3-4-6-9-12(2)16-14(15)13-10-7-5-8-11-13/h5,7-8,10-11H,2-4,6,9H2,1H3