(2-azanyl-2-oxidanylidene-ethyl) 3-[(4-bromophenyl)carbonylamino]propanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3-[(4-bromophenyl)carbonylamino]propanoate Openeye Name: (2-amino-2-oxo-ethyl) 3-[(4-bromobenzoyl)amino]propanoate CAS Name: 3-[[(4-bromophenyl)-oxomethyl]amino]propanoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3-[(4-bromobenzoyl)amino]propanoate Traditional Name: 3-[(4-bromobenzoyl)amino]propionic acid (2-amino-2-keto-ethyl) ester Formula: C12H13BrN2O4 MolecularWeight: 329.14662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCC(=O)OCC(=O)N)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCC(=O)OCC(=O)N)Br

InChI

InChI=1S/C12H13BrN2O4/c13-9-3-1-8(2-4-9)12(18)15-6-5-11(17)19-7-10(14)16/h1-4H,5-7H2,(H2,14,16)(H,15,18)