2-(6-ethyl-1,3-benzodioxol-5-yl)ethanoic acid

Systemtic Name: 2-(6-ethyl-1,3-benzodioxol-5-yl)ethanoic acid Openeye Name: 2-(6-ethyl-1,3-benzodioxol-5-yl)acetic acid CAS Name: 2-(6-ethyl-1,3-benzodioxol-5-yl)acetic acid IUPAC Name: 2-(6-ethyl-1,3-benzodioxol-5-yl)acetic acid Traditional Name: 2-(6-ethyl-1,3-benzodioxol-5-yl)acetic acid Formula: C11H12O4 MolecularWeight: 208.21058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1CC(=O)O)OCO2

Isomeric SMILES

CCC1=CC2=C(C=C1CC(=O)O)OCO2

InChI

InChI=1S/C11H12O4/c1-2-7-3-9-10(15-6-14-9)4-8(7)5-11(12)13/h3-4H,2,5-6H2,1H3,(H,12,13)