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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-5,5-dimethyl-3-oxidanyl-hexanoate Openeye Name: 2-(1,3-benzodioxol-5-yl)-3-hydroxy-5,5-dimethyl-hexanoate CAS Name: 2-(1,3-benzodioxol-5-yl)-3-hydroxy-5,5-dimethylhexanoate IUPAC Name: 2-(1,3-benzodioxol-5-yl)-3-hydroxy-5,5-dimethylhexanoate Traditional Name: 2-(1,3-benzodioxol-5-yl)-3-hydroxy-5,5-dimethyl-hexanoate Formula: C15H19O5- MolecularWeight: 279.30836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(C1=CC2=C(C=C1)OCO2)C(=O)[O-])O

Isomeric SMILES

CC(C)(C)CC(C(C1=CC2=C(C=C1)OCO2)C(=O)[O-])O

InChI

InChI=1S/C15H20O5/c1-15(2,3)7-10(16)13(14(17)18)9-4-5-11-12(6-9)20-8-19-11/h4-6,10,13,16H,7-8H2,1-3H3,(H,17,18)/p-1