6-oxidanylidenehex-1-en-3-yl benzoate

Systemtic Name: 6-oxidanylidenehex-1-en-3-yl benzoate Openeye Name: (4-oxo-1-vinyl-butyl) benzoate CAS Name: benzoic acid 6-oxohex-1-en-3-yl ester IUPAC Name: 6-oxohex-1-en-3-yl benzoate Traditional Name: benzoic acid 1-(3-ketopropyl)allyl ester Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O3/c1-2-12(9-6-10-14)16-13(15)11-7-4-3-5-8-11/h2-5,7-8,10,12H,1,6,9H2