2-[5-(hydroxymethyl)-3-(phenylmethyl)-4H-1,2-oxazol-5-yl]ethanoic acid

Systemtic Name: 2-[5-(hydroxymethyl)-3-(phenylmethyl)-4H-1,2-oxazol-5-yl]ethanoic acid Openeye Name: 2-[3-benzyl-5-(hydroxymethyl)-4H-isoxazol-5-yl]acetic acid CAS Name: 2-[5-(hydroxymethyl)-3-(phenylmethyl)-4H-isoxazol-5-yl]acetic acid IUPAC Name: 2-[3-benzyl-5-(hydroxymethyl)-4H-1,2-oxazol-5-yl]acetic acid Traditional Name: 2-(3-benzyl-5-methylol-2-isoxazolin-5-yl)acetic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NOC1(CC(=O)O)CO)CC2=CC=CC=C2

Isomeric SMILES

C1C(=NOC1(CC(=O)O)CO)CC2=CC=CC=C2

InChI

InChI=1S/C13H15NO4/c15-9-13(8-12(16)17)7-11(14-18-13)6-10-4-2-1-3-5-10/h1-5,15H,6-9H2,(H,16,17)