5-(2-azanylethyl)-1,2-oxazol-3-one bromide

Systemtic Name: 5-(2-azanylethyl)-1,2-oxazol-3-one bromide Openeye Name: 5-(2-aminoethyl)isoxazol-3-one bromide CAS Name: 5-(2-aminoethyl)-3-isoxazolone bromide IUPAC Name: 5-(2-aminoethyl)-1,2-oxazol-3-one bromide Traditional Name: 5-(2-aminoethyl)-4-isoxazolin-3-one bromide Formula: C5H8BrN2O2- MolecularWeight: 208.03322

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(ONC1=O)CCN.[Br-]

Isomeric SMILES

C1=C(ONC1=O)CCN.[Br-]

InChI

InChI=1S/C5H8N2O2.BrH/c6-2-1-4-3-5(8)7-9-4;/h3H,1-2,6H2,(H,7,8);1H/p-1