7-nitro-1,3-benzodioxole-5-carboxylic acid

Systemtic Name: 7-nitro-1,3-benzodioxole-5-carboxylic acid Openeye Name: 7-nitro-1,3-benzodioxole-5-carboxylic acid CAS Name: 7-nitro-1,3-benzodioxole-5-carboxylic acid IUPAC Name: 7-nitro-1,3-benzodioxole-5-carboxylic acid Traditional Name: 7-nitro-piperonylic acid Formula: C8H5NO6 MolecularWeight: 211.1284

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC(=CC(=C2O1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1OC2=CC(=CC(=C2O1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C8H5NO6/c10-8(11)4-1-5(9(12)13)7-6(2-4)14-3-15-7/h1-2H,3H2,(H,10,11)