[(2R)-1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-(4-bromanylphenoxy)propanoate

Systemtic Name: [(2R)-1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-(4-bromanylphenoxy)propanoate Openeye Name: [(1R)-2-(tert-butylcarbamoylamino)-1-methyl-2-oxo-ethyl] (2S)-2-(4-bromophenoxy)propanoate CAS Name: (2S)-2-(4-bromophenoxy)propanoic acid [(2R)-1-[[(tert-butylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl] (2S)-2-(4-bromophenoxy)propanoate Traditional Name: (2S)-2-(4-bromophenoxy)propionic acid [(1R)-2-(tert-butylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H23BrN2O5 MolecularWeight: 415.27892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC(C)(C)C)OC(=O)C(C)OC1=CC=C(C=C1)Br

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC(C)(C)C)OC(=O)[C@H](C)OC1=CC=C(C=C1)Br

InChI

InChI=1S/C17H23BrN2O5/c1-10(14(21)19-16(23)20-17(3,4)5)25-15(22)11(2)24-13-8-6-12(18)7-9-13/h6-11H,1-5H3,(H2,19,20,21,23)/t10-,11+/m1/s1