(3S,4S)-4-(1,3-benzodioxol-5-ylmethyl)-3-oxidanyl-oxolan-2-one

Systemtic Name: (3S,4S)-4-(1,3-benzodioxol-5-ylmethyl)-3-oxidanyl-oxolan-2-one Openeye Name: (3S,4S)-4-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-tetrahydrofuran-2-one CAS Name: (3S,4S)-4-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-2-oxolanone IUPAC Name: (3S,4S)-4-(1,3-benzodioxol-5-ylmethyl)-3-hydroxyoxolan-2-one Traditional Name: (3S,4S)-3-hydroxy-4-piperonyl-tetrahydrofuran-2-one Formula: C12H12O5 MolecularWeight: 236.22068

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(=O)O1)O)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1[C@@H]([C@@H](C(=O)O1)O)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H12O5/c13-11-8(5-15-12(11)14)3-7-1-2-9-10(4-7)17-6-16-9/h1-2,4,8,11,13H,3,5-6H2/t8-,11-/m0/s1