2-(1,3-benzodioxol-5-ylmethylamino)benzoate

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylamino)benzoate Openeye Name: 2-(1,3-benzodioxol-5-ylmethylamino)benzoate CAS Name: 2-(1,3-benzodioxol-5-ylmethylamino)benzoate IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylamino)benzoate Traditional Name: 2-(piperonylamino)benzoate Formula: C15H12NO4- MolecularWeight: 270.26008

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=CC=CC=C3C(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=CC=CC=C3C(=O)[O-]

InChI

InChI=1S/C15H13NO4/c17-15(18)11-3-1-2-4-12(11)16-8-10-5-6-13-14(7-10)20-9-19-13/h1-7,16H,8-9H2,(H,17,18)/p-1