(2S)-2-(1,3-benzodioxol-5-yloxy)-3-methyl-butanoic acid

Systemtic Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-3-methyl-butanoic acid Openeye Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-3-methyl-butanoic acid CAS Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-3-methylbutanoic acid IUPAC Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-3-methylbutanoic acid Traditional Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-3-methyl-butyric acid Formula: C12H14O5 MolecularWeight: 238.23656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)OC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)[C@@H](C(=O)O)OC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C12H14O5/c1-7(2)11(12(13)14)17-8-3-4-9-10(5-8)16-6-15-9/h3-5,7,11H,6H2,1-2H3,(H,13,14)/t11-/m0/s1