[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] (2S)-2-(4-bromanylphenoxy)propanoate

Systemtic Name: [2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] (2S)-2-(4-bromanylphenoxy)propanoate Openeye Name: [2-[[(1S)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] (2S)-2-(4-bromophenoxy)propanoate CAS Name: (2S)-2-(4-bromophenoxy)propanoic acid [2-[[[[(2S)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl] (2S)-2-(4-bromophenoxy)propanoate Traditional Name: (2S)-2-(4-bromophenoxy)propionic acid [2-keto-2-[[(1S)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C16H21BrN2O5 MolecularWeight: 401.25234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)COC(=O)C(C)OC1=CC=C(C=C1)Br

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrN2O5/c1-4-10(2)18-16(22)19-14(20)9-23-15(21)11(3)24-13-7-5-12(17)6-8-13/h5-8,10-11H,4,9H2,1-3H3,(H2,18,19,20,22)/t10-,11-/m0/s1