[(1S)-1-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-ethyl] ethanoate

Systemtic Name: [(1S)-1-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-ethyl] ethanoate Openeye Name: [(1S)-1-(3,4-dihydroxyphenyl)-2-hydroxy-ethyl] acetate CAS Name: acetic acid [(1S)-1-(3,4-dihydroxyphenyl)-2-hydroxyethyl] ester IUPAC Name: [(1S)-1-(3,4-dihydroxyphenyl)-2-hydroxyethyl] acetate Traditional Name: acetic acid [(1S)-1-(3,4-dihydroxyphenyl)-2-hydroxy-ethyl] ester Formula: C10H12O5 MolecularWeight: 212.19928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12O5/c1-6(12)15-10(5-11)7-2-3-8(13)9(14)4-7/h2-4,10-11,13-14H,5H2,1H3/t10-/m1/s1