[2-oxidanylidene-2-[(3-oxidanylidene-1-phenyl-butan-2-yl)amino]ethyl] 2-(4-bromanylphenoxy)propanoate

Systemtic Name: [2-oxidanylidene-2-[(3-oxidanylidene-1-phenyl-butan-2-yl)amino]ethyl] 2-(4-bromanylphenoxy)propanoate Openeye Name: [2-[(1-benzyl-2-oxo-propyl)amino]-2-oxo-ethyl] 2-(4-bromophenoxy)propanoate CAS Name: 2-(4-bromophenoxy)propanoic acid [2-oxo-2-[(3-oxo-1-phenylbutan-2-yl)amino]ethyl] ester IUPAC Name: [2-oxo-2-[(3-oxo-1-phenylbutan-2-yl)amino]ethyl] 2-(4-bromophenoxy)propanoate Traditional Name: 2-(4-bromophenoxy)propionic acid [2-[(1-benzyl-2-keto-propyl)amino]-2-keto-ethyl] ester Formula: C21H22BrNO5 MolecularWeight: 448.30708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC(CC1=CC=CC=C1)C(=O)C)OC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C(=O)OCC(=O)NC(CC1=CC=CC=C1)C(=O)C)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C21H22BrNO5/c1-14(24)19(12-16-6-4-3-5-7-16)23-20(25)13-27-21(26)15(2)28-18-10-8-17(22)9-11-18/h3-11,15,19H,12-13H2,1-2H3,(H,23,25)