[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-[(4-bromophenyl)carbonylamino]propanoate

Systemtic Name: [(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-[(4-bromophenyl)carbonylamino]propanoate Openeye Name: [(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethyl] (2S)-2-[(4-bromobenzoyl)amino]propanoate CAS Name: (2S)-2-[[(4-bromophenyl)-oxomethyl]amino]propanoic acid [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] (2S)-2-[(4-bromobenzoyl)amino]propanoate Traditional Name: (2S)-2-[(4-bromobenzoyl)amino]propionic acid [(1S)-2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H23BrN2O4 MolecularWeight: 399.27952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23BrN2O4/c1-10(2)9-19-15(21)12(4)24-17(23)11(3)20-16(22)13-5-7-14(18)8-6-13/h5-8,10-12H,9H2,1-4H3,(H,19,21)(H,20,22)/t11-,12-/m0/s1