2-(1,3-benzodioxol-5-yloxy)hexanoic acid

Systemtic Name: 2-(1,3-benzodioxol-5-yloxy)hexanoic acid Openeye Name: 2-(1,3-benzodioxol-5-yloxy)hexanoic acid CAS Name: 2-(1,3-benzodioxol-5-yloxy)hexanoic acid IUPAC Name: 2-(1,3-benzodioxol-5-yloxy)hexanoic acid Traditional Name: 2-(1,3-benzodioxol-5-yloxy)hexanoic acid Formula: C13H16O5 MolecularWeight: 252.26314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O5/c1-2-3-4-11(13(14)15)18-9-5-6-10-12(7-9)17-8-16-10/h5-7,11H,2-4,8H2,1H3,(H,14,15)