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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2-oxidanylidene-butanoic acid Openeye Name: 3-(1,3-benzodioxol-5-yl)-2-oxo-butanoic acid CAS Name: 3-(1,3-benzodioxol-5-yl)-2-oxobutanoic acid IUPAC Name: 3-(1,3-benzodioxol-5-yl)-2-oxobutanoic acid Traditional Name: 3-(1,3-benzodioxol-5-yl)-2-keto-butyric acid Formula: C11H10O5 MolecularWeight: 222.1941

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)C(=O)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)C(=O)C(=O)O

InChI

InChI=1S/C11H10O5/c1-6(10(12)11(13)14)7-2-3-8-9(4-7)16-5-15-8/h2-4,6H,5H2,1H3,(H,13,14)