(2S,3S)-2,3-bis(1,3-benzodioxol-5-ylmethyl)butane-1,4-diol

Systemtic Name: (2S,3S)-2,3-bis(1,3-benzodioxol-5-ylmethyl)butane-1,4-diol Openeye Name: (2S,3S)-2,3-bis(1,3-benzodioxol-5-ylmethyl)butane-1,4-diol CAS Name: (2S,3S)-2,3-bis(1,3-benzodioxol-5-ylmethyl)butane-1,4-diol IUPAC Name: (2S,3S)-2,3-bis(1,3-benzodioxol-5-ylmethyl)butane-1,4-diol Traditional Name: (2S,3S)-2,3-dipiperonylbutane-1,4-diol Formula: C20H22O6 MolecularWeight: 358.38508

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC(CO)C(CC3=CC4=C(C=C3)OCO4)CO

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[C@H](CO)[C@H](CC3=CC4=C(C=C3)OCO4)CO

InChI

InChI=1S/C20H22O6/c21-9-15(5-13-1-3-17-19(7-13)25-11-23-17)16(10-22)6-14-2-4-18-20(8-14)26-12-24-18/h1-4,7-8,15-16,21-22H,5-6,9-12H2/t15-,16-/m1/s1