[(E,4R,5R)-4,5-bis(oxidanyl)hex-2-enyl] benzoate

Systemtic Name: [(E,4R,5R)-4,5-bis(oxidanyl)hex-2-enyl] benzoate Openeye Name: [(E,4R,5R)-4,5-dihydroxyhex-2-enyl] benzoate CAS Name: benzoic acid [(E,4R,5R)-4,5-dihydroxyhex-2-enyl] ester IUPAC Name: [(E,4R,5R)-4,5-dihydroxyhex-2-enyl] benzoate Traditional Name: benzoic acid [(E,4R,5R)-4,5-dihydroxyhex-2-enyl] ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C=CCOC(=O)C1=CC=CC=C1)O)O

Isomeric SMILES

C[C@H]([C@@H](/C=C/COC(=O)C1=CC=CC=C1)O)O

InChI

InChI=1S/C13H16O4/c1-10(14)12(15)8-5-9-17-13(16)11-6-3-2-4-7-11/h2-8,10,12,14-15H,9H2,1H3/b8-5+/t10-,12-/m1/s1