3-[5-(1,3-benzodioxol-5-ylmethyl)-4,5-dihydro-1,2-oxazol-3-yl]propanoic acid

Systemtic Name: 3-[5-(1,3-benzodioxol-5-ylmethyl)-4,5-dihydro-1,2-oxazol-3-yl]propanoic acid Openeye Name: 3-[5-(1,3-benzodioxol-5-ylmethyl)-4,5-dihydroisoxazol-3-yl]propanoic acid CAS Name: 3-[5-(1,3-benzodioxol-5-ylmethyl)-4,5-dihydroisoxazol-3-yl]propanoic acid IUPAC Name: 3-[5-(1,3-benzodioxol-5-ylmethyl)-4,5-dihydro-1,2-oxazol-3-yl]propanoic acid Traditional Name: 3-(5-piperonyl-2-isoxazolin-3-yl)propionic acid Formula: C14H15NO5 MolecularWeight: 277.2726

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1CCC(=O)O)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1C(ON=C1CCC(=O)O)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H15NO5/c16-14(17)4-2-10-7-11(20-15-10)5-9-1-3-12-13(6-9)19-8-18-12/h1,3,6,11H,2,4-5,7-8H2,(H,16,17)