4-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethyl)but-3-yne-1,2-diol

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethyl)but-3-yne-1,2-diol Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethyl)but-3-yne-1,2-diol CAS Name: 4-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethyl)-3-butyne-1,2-diol IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethyl)but-3-yne-1,2-diol Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-piperonyl-but-3-yne-1,2-diol Formula: C19H16O6 MolecularWeight: 340.32674

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C19H16O6/c20-10-19(21,9-14-2-4-16-18(8-14)25-12-23-16)6-5-13-1-3-15-17(7-13)24-11-22-15/h1-4,7-8,20-21H,9-12H2