3-(1,3-benzodioxol-5-yl)-5-ethoxy-5-oxidanylidene-pentanoic acid

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-ethoxy-5-oxidanylidene-pentanoic acid Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-ethoxy-5-oxo-pentanoic acid CAS Name: 3-(1,3-benzodioxol-5-yl)-5-ethoxy-5-oxopentanoic acid IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-ethoxy-5-oxopentanoic acid Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-ethoxy-5-keto-valeric acid Formula: C14H16O6 MolecularWeight: 280.27324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O6/c1-2-18-14(17)7-10(6-13(15)16)9-3-4-11-12(5-9)20-8-19-11/h3-5,10H,2,6-8H2,1H3,(H,15,16)