2-benzamidopropanoic acid; 1,3-bis(bromanyl)propan-2-one

Systemtic Name: 2-benzamidopropanoic acid; 1,3-bis(bromanyl)propan-2-one Openeye Name: 2-benzamidopropanoic acid; 1,3-dibromopropan-2-one CAS Name: 2-benzamidopropanoic acid; 1,3-dibromo-2-propanone IUPAC Name: 2-benzamidopropanoic acid; 1,3-dibromopropan-2-one Traditional Name: 2-benzamidopropionic acid; 1,3-dibromoacetone Formula: C13H15Br2NO4 MolecularWeight: 409.0705

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO3.C3H4Br2O/c1-7(10(13)14)11-9(12)8-5-3-2-4-6-8;4-1-3(6)2-5/h2-7H,1H3,(H,11,12)(H,13,14);1-2H2