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

Systemtic Name: 2-(6-acetamido-1,3-benzodioxol-5-yl)ethanoic acid Openeye Name: 2-(6-acetamido-1,3-benzodioxol-5-yl)acetic acid CAS Name: 2-(6-acetamido-1,3-benzodioxol-5-yl)acetic acid IUPAC Name: 2-(6-acetamido-1,3-benzodioxol-5-yl)acetic acid Traditional Name: 2-(6-acetamido-1,3-benzodioxol-5-yl)acetic acid Formula: C11H11NO5 MolecularWeight: 237.20874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1CC(=O)O)OCO2

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1CC(=O)O)OCO2

InChI

InChI=1S/C11H11NO5/c1-6(13)12-8-4-10-9(16-5-17-10)2-7(8)3-11(14)15/h2,4H,3,5H2,1H3,(H,12,13)(H,14,15)