(2R)-3-[4-[2,5-bis(bromanyl)phenyl]carbonylphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: (2R)-3-[4-[2,5-bis(bromanyl)phenyl]carbonylphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: (2R)-2-(tert-butoxycarbonylamino)-3-[4-(2,5-dibromobenzoyl)phenyl]propanoic acid CAS Name: (2R)-3-[4-[(2,5-dibromophenyl)-oxomethyl]phenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: (2R)-3-[4-(2,5-dibromobenzoyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: (2R)-2-(tert-butoxycarbonylamino)-3-[4-(2,5-dibromobenzoyl)phenyl]propionic acid Formula: C21H21Br2NO5 MolecularWeight: 527.20314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)Br)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)Br)C(=O)O

InChI

InChI=1S/C21H21Br2NO5/c1-21(2,3)29-20(28)24-17(19(26)27)10-12-4-6-13(7-5-12)18(25)15-11-14(22)8-9-16(15)23/h4-9,11,17H,10H2,1-3H3,(H,24,28)(H,26,27)/t17-/m1/s1