3-[(1-methylbenzimidazol-2-yl)carbonylamino]propanoic acid dihydrobromide

Systemtic Name: 3-[(1-methylbenzimidazol-2-yl)carbonylamino]propanoic acid dihydrobromide Openeye Name: 3-[(1-methylbenzimidazole-2-carbonyl)amino]propanoic acid dihydrobromide CAS Name: 3-[[(1-methyl-2-benzimidazolyl)-oxomethyl]amino]propanoic acid dihydrobromide IUPAC Name: 3-[(1-methylbenzimidazole-2-carbonyl)amino]propanoic acid dihydrobromide Traditional Name: 3-[(1-methylbenzimidazole-2-carbonyl)amino]propionic acid dihydrobromide Formula: C12H15Br2N3O3 MolecularWeight: 409.0738

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(=O)NCCC(=O)O.Br.Br

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C(=O)NCCC(=O)O.Br.Br

InChI

InChI=1S/C12H13N3O3.2BrH/c1-15-9-5-3-2-4-8(9)14-11(15)12(18)13-7-6-10(16)17;;/h2-5H,6-7H2,1H3,(H,13,18)(H,16,17);2*1H