[(3R,4S,5R)-4,5-dimethoxy-6-oxidanylidene-hex-1-en-3-yl] benzoate

Systemtic Name: [(3R,4S,5R)-4,5-dimethoxy-6-oxidanylidene-hex-1-en-3-yl] benzoate Openeye Name: [(1R,2S,3R)-2,3-dimethoxy-4-oxo-1-vinyl-butyl] benzoate CAS Name: benzoic acid [(3R,4S,5R)-4,5-dimethoxy-6-oxohex-1-en-3-yl] ester IUPAC Name: [(3R,4S,5R)-4,5-dimethoxy-6-oxohex-1-en-3-yl] benzoate Traditional Name: benzoic acid [(1R)-1-[(1S,2R)-3-keto-1,2-dimethoxy-propyl]allyl] ester Formula: C15H18O5 MolecularWeight: 278.30042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CO[C@@H](C=O)[C@H]([C@@H](C=C)OC(=O)C1=CC=CC=C1)OC

InChI

InChI=1S/C15H18O5/c1-4-12(14(19-3)13(10-16)18-2)20-15(17)11-8-6-5-7-9-11/h4-10,12-14H,1H2,2-3H3/t12-,13+,14+/m1/s1