3,3-bis(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethyl)prop-2-enoic acid

Systemtic Name: 3,3-bis(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethyl)prop-2-enoic acid Openeye Name: 3,3-bis(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethyl)prop-2-enoic acid CAS Name: 3,3-bis(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethyl)-2-propenoic acid IUPAC Name: 3,3-bis(1,3-benzodioxol-5-yl)-2-(1,3-benzodioxol-5-ylmethyl)prop-2-enoic acid Traditional Name: 3,3-bis(1,3-benzodioxol-5-yl)-2-piperonyl-acrylic acid Formula: C25H18O8 MolecularWeight: 446.40562

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC(=C(C3=CC4=C(C=C3)OCO4)C5=CC6=C(C=C5)OCO6)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC(=C(C3=CC4=C(C=C3)OCO4)C5=CC6=C(C=C5)OCO6)C(=O)O

InChI

InChI=1S/C25H18O8/c26-25(27)17(7-14-1-4-18-21(8-14)31-11-28-18)24(15-2-5-19-22(9-15)32-12-29-19)16-3-6-20-23(10-16)33-13-30-20/h1-6,8-10H,7,11-13H2,(H,26,27)