oxiran-2-ylmethyl 4-[2,2,2-tris(bromanyl)ethanoylamino]benzoate

Systemtic Name: oxiran-2-ylmethyl 4-[2,2,2-tris(bromanyl)ethanoylamino]benzoate Openeye Name: oxiran-2-ylmethyl 4-[(2,2,2-tribromoacetyl)amino]benzoate CAS Name: 4-[(2,2,2-tribromo-1-oxoethyl)amino]benzoic acid 2-oxiranylmethyl ester IUPAC Name: oxiran-2-ylmethyl 4-[(2,2,2-tribromoacetyl)amino]benzoate Traditional Name: 4-[(2,2,2-tribromoacetyl)amino]benzoic acid glycidyl ester Formula: C12H10Br3NO4 MolecularWeight: 471.9241

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)COC(=O)C2=CC=C(C=C2)NC(=O)C(Br)(Br)Br

Isomeric SMILES

C1C(O1)COC(=O)C2=CC=C(C=C2)NC(=O)C(Br)(Br)Br

InChI

InChI=1S/C12H10Br3NO4/c13-12(14,15)11(18)16-8-3-1-7(2-4-8)10(17)20-6-9-5-19-9/h1-4,9H,5-6H2,(H,16,18)