methyl (2S)-3-(4-bromanyl-1H-imidazol-5-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl (2S)-3-(4-bromanyl-1H-imidazol-5-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2S)-3-(4-bromo-1H-imidazol-5-yl)-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2S)-3-(4-bromo-1H-imidazol-5-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-bromo-1H-imidazol-5-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-3-(4-bromo-1H-imidazol-5-yl)-2-(tert-butoxycarbonylamino)propionic acid methyl ester Formula: C12H18BrN3O4 MolecularWeight: 348.19302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=C(N=CN1)Br)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=C(N=CN1)Br)C(=O)OC

InChI

InChI=1S/C12H18BrN3O4/c1-12(2,3)20-11(18)16-8(10(17)19-4)5-7-9(13)15-6-14-7/h6,8H,5H2,1-4H3,(H,14,15)(H,16,18)/t8-/m0/s1