2,4-bis(1,3-benzodioxol-5-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 2,4-bis(1,3-benzodioxol-5-yl)-4-oxidanylidene-butanoic acid Openeye Name: 2,4-bis(1,3-benzodioxol-5-yl)-4-oxo-butanoic acid CAS Name: 2,4-bis(1,3-benzodioxol-5-yl)-4-oxobutanoic acid IUPAC Name: 2,4-bis(1,3-benzodioxol-5-yl)-4-oxobutanoic acid Traditional Name: 2,4-bis(1,3-benzodioxol-5-yl)-4-keto-butyric acid Formula: C18H14O7 MolecularWeight: 342.29956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14O7/c19-13(11-2-4-15-17(6-11)25-9-23-15)7-12(18(20)21)10-1-3-14-16(5-10)24-8-22-14/h1-6,12H,7-9H2,(H,20,21)