(2S)-3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)propane-1,2-diol

Systemtic Name: (2S)-3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)propane-1,2-diol Openeye Name: (2S)-3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)propane-1,2-diol CAS Name: (2S)-3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)propane-1,2-diol IUPAC Name: (2S)-3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)propane-1,2-diol Traditional Name: (2S)-3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)propane-1,2-diol Formula: C12H16O6 MolecularWeight: 256.25184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C(=C1)CC(CO)O)OC)OCO2

Isomeric SMILES

COC1=C2C(=C(C(=C1)C[C@@H](CO)O)OC)OCO2

InChI

InChI=1S/C12H16O6/c1-15-9-4-7(3-8(14)5-13)10(16-2)12-11(9)17-6-18-12/h4,8,13-14H,3,5-6H2,1-2H3/t8-/m0/s1