butyl 4-[2-[2-[(3-bromophenyl)carbonylamino]ethanoyloxy]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[2-[(3-bromophenyl)carbonylamino]ethanoyloxy]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[2-[(3-bromobenzoyl)amino]acetyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[2-[[(3-bromophenyl)-oxomethyl]amino]-1-oxoethoxy]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[2-[(3-bromobenzoyl)amino]acetyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[2-[(3-bromobenzoyl)amino]acetyl]oxyacetyl]amino]benzoic acid butyl ester Formula: C22H23BrN2O6 MolecularWeight: 491.33182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CNC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CNC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C22H23BrN2O6/c1-2-3-11-30-22(29)15-7-9-18(10-8-15)25-19(26)14-31-20(27)13-24-21(28)16-5-4-6-17(23)12-16/h4-10,12H,2-3,11,13-14H2,1H3,(H,24,28)(H,25,26)