2-acetamido-3-(3-bromanyl-1,2-oxazol-5-yl)propanoic acid

Systemtic Name: 2-acetamido-3-(3-bromanyl-1,2-oxazol-5-yl)propanoic acid Openeye Name: 2-acetamido-3-(3-bromoisoxazol-5-yl)propanoic acid CAS Name: 2-acetamido-3-(3-bromo-5-isoxazolyl)propanoic acid IUPAC Name: 2-acetamido-3-(3-bromo-1,2-oxazol-5-yl)propanoic acid Traditional Name: 2-acetamido-3-(3-bromoisoxazol-5-yl)propionic acid Formula: C8H9BrN2O4 MolecularWeight: 277.07206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC(=NO1)Br)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=CC(=NO1)Br)C(=O)O

InChI

InChI=1S/C8H9BrN2O4/c1-4(12)10-6(8(13)14)2-5-3-7(9)11-15-5/h3,6H,2H2,1H3,(H,10,12)(H,13,14)