[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-[(3-bromophenyl)methoxy]benzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-[(3-bromophenyl)methoxy]benzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 2-[(3-bromophenyl)methoxy]benzoate CAS Name: 2-[(3-bromophenyl)methoxy]benzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-[(3-bromophenyl)methoxy]benzoate Traditional Name: 2-(3-bromobenzyl)oxybenzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H21BrN2O5 MolecularWeight: 449.29514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)C1=CC=CC=C1OCC2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC(=O)C1=CC=CC=C1OCC2=CC(=CC=C2)Br

InChI

InChI=1S/C20H21BrN2O5/c1-13(2)22-20(26)23-18(24)12-28-19(25)16-8-3-4-9-17(16)27-11-14-6-5-7-15(21)10-14/h3-10,13H,11-12H2,1-2H3,(H2,22,23,24,26)