[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl] 2-(3-bromanylphenoxy)ethanoate

Systemtic Name: [2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl] 2-(3-bromanylphenoxy)ethanoate Openeye Name: [2-(isoxazol-3-ylamino)-2-oxo-ethyl] 2-(3-bromophenoxy)acetate CAS Name: 2-(3-bromophenoxy)acetic acid [2-(3-isoxazolylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,2-oxazol-3-ylamino)-2-oxoethyl] 2-(3-bromophenoxy)acetate Traditional Name: 2-(3-bromophenoxy)acetic acid [2-(isoxazol-3-ylamino)-2-keto-ethyl] ester Formula: C13H11BrN2O5 MolecularWeight: 355.14084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCC(=O)OCC(=O)NC2=NOC=C2

Isomeric SMILES

C1=CC(=CC(=C1)Br)OCC(=O)OCC(=O)NC2=NOC=C2

InChI

InChI=1S/C13H11BrN2O5/c14-9-2-1-3-10(6-9)19-8-13(18)20-7-12(17)15-11-4-5-21-16-11/h1-6H,7-8H2,(H,15,16,17)