(2S,3S)-3-(4-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propanoic acid

Systemtic Name: (2S,3S)-3-(4-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propanoic acid Openeye Name: (2S,3S)-3-(4-bromophenyl)-3-(tert-butoxycarbonylamino)-2-hydroxy-propanoic acid CAS Name: (2S,3S)-3-(4-bromophenyl)-2-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: (2S,3S)-3-(4-bromophenyl)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: (2S,3S)-3-(4-bromophenyl)-3-(tert-butoxycarbonylamino)-2-hydroxy-propionic acid Formula: C14H18BrNO5 MolecularWeight: 360.20042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrNO5/c1-14(2,3)21-13(20)16-10(11(17)12(18)19)8-4-6-9(15)7-5-8/h4-7,10-11,17H,1-3H3,(H,16,20)(H,18,19)/t10-,11-/m0/s1