2-azanyl-3-[5-(5-bromanylfuran-2-yl)-3-oxidanylidene-1,2-oxazol-4-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[5-(5-bromanylfuran-2-yl)-3-oxidanylidene-1,2-oxazol-4-yl]propanoic acid Openeye Name: 2-amino-3-[5-(5-bromo-2-furyl)-3-oxo-isoxazol-4-yl]propanoic acid CAS Name: 2-amino-3-[5-(5-bromo-2-furanyl)-3-oxo-4-isoxazolyl]propanoic acid IUPAC Name: 2-amino-3-[5-(5-bromofuran-2-yl)-3-oxo-1,2-oxazol-4-yl]propanoic acid Traditional Name: 2-amino-3-[5-(5-bromo-2-furyl)-3-keto-4-isoxazolin-4-yl]propionic acid Formula: C10H9BrN2O5 MolecularWeight: 317.09286

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)Br)C2=C(C(=O)NO2)CC(C(=O)O)N

Isomeric SMILES

C1=C(OC(=C1)Br)C2=C(C(=O)NO2)CC(C(=O)O)N

InChI

InChI=1S/C10H9BrN2O5/c11-7-2-1-6(17-7)8-4(9(14)13-18-8)3-5(12)10(15)16/h1-2,5H,3,12H2,(H,13,14)(H,15,16)