[(2R,3S,4R)-3,4-bis(oxidanyl)-2-prop-2-enoyloxy-hex-5-enyl] benzoate

Systemtic Name: [(2R,3S,4R)-3,4-bis(oxidanyl)-2-prop-2-enoyloxy-hex-5-enyl] benzoate Openeye Name: [(2R,3S,4R)-3,4-dihydroxy-2-prop-2-enoyloxy-hex-5-enyl] benzoate CAS Name: benzoic acid [(2R,3S,4R)-3,4-dihydroxy-2-(1-oxoprop-2-enoxy)hex-5-enyl] ester IUPAC Name: [(2R,3S,4R)-3,4-dihydroxy-2-prop-2-enoyloxyhex-5-enyl] benzoate Traditional Name: benzoic acid [(2R,3S,4R)-2-acryloyloxy-3,4-dihydroxy-hex-5-enyl] ester Formula: C16H18O6 MolecularWeight: 306.31052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18O6/c1-3-12(17)15(19)13(22-14(18)4-2)10-21-16(20)11-8-6-5-7-9-11/h3-9,12-13,15,17,19H,1-2,10H2/t12-,13-,15+/m1/s1