3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]oxypropanoic acid

Systemtic Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]oxypropanoic acid Openeye Name: 3-[(E)-1,3-benzodioxol-5-ylmethyleneamino]oxypropanoic acid CAS Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]oxypropanoic acid IUPAC Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]oxypropanoic acid Traditional Name: 3-[(E)-piperonylideneamino]oxypropionic acid Formula: C11H11NO5 MolecularWeight: 237.20874

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NOCCC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/OCCC(=O)O

InChI

InChI=1S/C11H11NO5/c13-11(14)3-4-17-12-6-8-1-2-9-10(5-8)16-7-15-9/h1-2,5-6H,3-4,7H2,(H,13,14)/b12-6+