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

Systemtic Name: 3-[5-(phenylmethyl)-4,5-dihydro-1,2-oxazol-3-yl]propanoic acid Openeye Name: 3-(5-benzyl-4,5-dihydroisoxazol-3-yl)propanoic acid CAS Name: 3-[5-(phenylmethyl)-4,5-dihydroisoxazol-3-yl]propanoic acid IUPAC Name: 3-(5-benzyl-4,5-dihydro-1,2-oxazol-3-yl)propanoic acid Traditional Name: 3-(5-benzyl-2-isoxazolin-3-yl)propionic acid Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1CCC(=O)O)CC2=CC=CC=C2

Isomeric SMILES

C1C(ON=C1CCC(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C13H15NO3/c15-13(16)7-6-11-9-12(17-14-11)8-10-4-2-1-3-5-10/h1-5,12H,6-9H2,(H,15,16)