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

Systemtic Name: [(3R,4S,5S)-4,5-dimethoxy-6-oxidanyl-hex-1-en-3-yl] benzoate Openeye Name: [(1R,2S,3S)-4-hydroxy-2,3-dimethoxy-1-vinyl-butyl] benzoate CAS Name: benzoic acid [(3R,4S,5S)-6-hydroxy-4,5-dimethoxyhex-1-en-3-yl] ester IUPAC Name: [(3R,4S,5S)-6-hydroxy-4,5-dimethoxyhex-1-en-3-yl] benzoate Traditional Name: benzoic acid [(1R)-1-[(1S,2S)-3-hydroxy-1,2-dimethoxy-propyl]allyl] ester Formula: C15H20O5 MolecularWeight: 280.3163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20O5/c1-4-12(14(19-3)13(10-16)18-2)20-15(17)11-8-6-5-7-9-11/h4-9,12-14,16H,1,10H2,2-3H3/t12-,13+,14+/m1/s1