(2R,3R)-4-acetyloxy-3-[(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoyl]oxy-2-oxidanyl-butanoic acid

Systemtic Name: (2R,3R)-4-acetyloxy-3-[(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoyl]oxy-2-oxidanyl-butanoic acid Openeye Name: (2R,3R)-4-acetoxy-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-2-hydroxy-butanoic acid CAS Name: (2R,3R)-4-acetyloxy-3-[(E)-3-(3,4-dihydroxyphenyl)-1-oxoprop-2-enoxy]-2-hydroxybutanoic acid IUPAC Name: (2R,3R)-4-acetyloxy-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-2-hydroxybutanoic acid Traditional Name: (2R,3R)-4-acetoxy-3-[(E)-3-(3,4-dihydroxyphenyl)acryloyl]oxy-2-hydroxy-butyric acid Formula: C15H16O9 MolecularWeight: 340.28214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C(C(=O)O)O)OC(=O)C=CC1=CC(=C(C=C1)O)O

Isomeric SMILES

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

InChI

InChI=1S/C15H16O9/c1-8(16)23-7-12(14(20)15(21)22)24-13(19)5-3-9-2-4-10(17)11(18)6-9/h2-6,12,14,17-18,20H,7H2,1H3,(H,21,22)/b5-3+/t12-,14-/m1/s1