2-(oxepin-3-yl)ethanoate

Systemtic Name: 2-(oxepin-3-yl)ethanoate Openeye Name: 2-(oxepin-3-yl)acetate CAS Name: 2-(3-oxepinyl)acetate IUPAC Name: 2-(oxepin-3-yl)acetate Traditional Name: 2-(oxepin-3-yl)acetate Formula: C8H7O3- MolecularWeight: 151.13938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=COC=C1)CC(=O)[O-]

Isomeric SMILES

C1=CC(=COC=C1)CC(=O)[O-]

InChI

InChI=1S/C8H8O3/c9-8(10)5-7-3-1-2-4-11-6-7/h1-4,6H,5H2,(H,9,10)/p-1