(2E)-3-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanyl-butanoic acid

Systemtic Name: (2E)-3-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanyl-butanoic acid Openeye Name: (2E)-3-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-benzodioxol-5-ylmethylene)-4-hydroxy-butanoic acid CAS Name: (2E)-3-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-benzodioxol-5-ylmethylidene)-4-hydroxybutanoic acid IUPAC Name: (2E)-3-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-benzodioxol-5-ylmethylidene)-4-hydroxybutanoic acid Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-[2-(1,3-benzodioxol-5-yl)-1-methylol-ethyl]acrylic acid Formula: C20H18O7 MolecularWeight: 370.35272

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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)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC(CO)/C(=C\C3=CC4=C(C=C3)OCO4)/C(=O)O

InChI

InChI=1S/C20H18O7/c21-9-14(5-12-1-3-16-18(7-12)26-10-24-16)15(20(22)23)6-13-2-4-17-19(8-13)27-11-25-17/h1-4,6-8,14,21H,5,9-11H2,(H,22,23)/b15-6+