5-ethanoyl-1,3-benzodioxole-2,2-dicarboxylic acid

Systemtic Name: 5-ethanoyl-1,3-benzodioxole-2,2-dicarboxylic acid Openeye Name: 5-acetyl-1,3-benzodioxole-2,2-dicarboxylic acid CAS Name: 5-acetyl-1,3-benzodioxole-2,2-dicarboxylic acid IUPAC Name: 5-acetyl-1,3-benzodioxole-2,2-dicarboxylic acid Traditional Name: 5-acetyl-1,3-benzodioxole-2,2-dicarboxylic acid Formula: C11H8O7 MolecularWeight: 252.17702

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(O2)(C(=O)O)C(=O)O

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC(O2)(C(=O)O)C(=O)O

InChI

InChI=1S/C11H8O7/c1-5(12)6-2-3-7-8(4-6)18-11(17-7,9(13)14)10(15)16/h2-4H,1H3,(H,13,14)(H,15,16)