(3S)-5-[3-ethanoyl-2,6-bis(oxidanyl)phenyl]-3-methoxy-oxolan-2-one

Systemtic Name: (3S)-5-[3-ethanoyl-2,6-bis(oxidanyl)phenyl]-3-methoxy-oxolan-2-one Openeye Name: (3S)-5-(3-acetyl-2,6-dihydroxy-phenyl)-3-methoxy-tetrahydrofuran-2-one CAS Name: (3S)-5-(3-acetyl-2,6-dihydroxyphenyl)-3-methoxy-2-oxolanone IUPAC Name: (3S)-5-(3-acetyl-2,6-dihydroxyphenyl)-3-methoxyoxolan-2-one Traditional Name: (3S)-5-(3-acetyl-2,6-dihydroxy-phenyl)-3-methoxy-tetrahydrofuran-2-one Formula: C13H14O6 MolecularWeight: 266.24666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=C(C=C1)O)C2CC(C(=O)O2)OC)O

Isomeric SMILES

CC(=O)C1=C(C(=C(C=C1)O)C2C[C@@H](C(=O)O2)OC)O

InChI

InChI=1S/C13H14O6/c1-6(14)7-3-4-8(15)11(12(7)16)9-5-10(18-2)13(17)19-9/h3-4,9-10,15-16H,5H2,1-2H3/t9?,10-/m0/s1