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6-acetamido-1,3-benzodioxole-5-carboxylic acid

6-acetamido-1,3-benzodioxole-5-carboxylic acid

Systemtic Name:6-acetamido-1,3-benzodioxole-5-carboxylic acid
Openeye Name:6-acetamido-1,3-benzodioxole-5-carboxylic acid
CAS Name:6-acetamido-1,3-benzodioxole-5-carboxylic acid
IUPAC Name:6-acetamido-1,3-benzodioxole-5-carboxylic acid
Traditional Name:6-acetamido-piperonylic acid
Formula: C10H9NO5
MolecularWeight: 223.18216
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1C(=O)O)OCO2


Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1C(=O)O)OCO2


InChI

InChI=1S/C10H9NO5/c1-5(12)11-7-3-9-8(15-4-16-9)2-6(7)10(13)14/h2-3H,4H2,1H3,(H,11,12)(H,13,14)


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