2-[(2-benzamido-3-phenyl-propanoyl)amino]propanoic acid; 1,3-bis(bromanyl)propan-2-one

Systemtic Name: 2-[(2-benzamido-3-phenyl-propanoyl)amino]propanoic acid; 1,3-bis(bromanyl)propan-2-one Openeye Name: 2-[(2-benzamido-3-phenyl-propanoyl)amino]propanoic acid; 1,3-dibromopropan-2-one CAS Name: 2-[(2-benzamido-1-oxo-3-phenylpropyl)amino]propanoic acid; 1,3-dibromo-2-propanone IUPAC Name: 2-[(2-benzamido-3-phenylpropanoyl)amino]propanoic acid; 1,3-dibromopropan-2-one Traditional Name: 2-[(2-benzamido-3-phenyl-propanoyl)amino]propionic acid; 1,3-dibromoacetone Formula: C22H24Br2N2O5 MolecularWeight: 556.24436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC=CC=C2.C(C(=O)CBr)Br

Isomeric SMILES

CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC=CC=C2.C(C(=O)CBr)Br

InChI

InChI=1S/C19H20N2O4.C3H4Br2O/c1-13(19(24)25)20-18(23)16(12-14-8-4-2-5-9-14)21-17(22)15-10-6-3-7-11-15;4-1-3(6)2-5/h2-11,13,16H,12H2,1H3,(H,20,23)(H,21,22)(H,24,25);1-2H2