3-(1,3-benzodioxol-5-yl)-2,2-dimethyl-3-oxidanyl-propanoic acid

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-2,2-dimethyl-3-oxidanyl-propanoic acid Openeye Name: 3-(1,3-benzodioxol-5-yl)-3-hydroxy-2,2-dimethyl-propanoic acid CAS Name: 3-(1,3-benzodioxol-5-yl)-3-hydroxy-2,2-dimethylpropanoic acid IUPAC Name: 3-(1,3-benzodioxol-5-yl)-3-hydroxy-2,2-dimethylpropanoic acid Traditional Name: 3-(1,3-benzodioxol-5-yl)-3-hydroxy-2,2-dimethyl-propionic acid Formula: C12H14O5 MolecularWeight: 238.23656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O5/c1-12(2,11(14)15)10(13)7-3-4-8-9(5-7)17-6-16-8/h3-5,10,13H,6H2,1-2H3,(H,14,15)