4-[[1-methyl-2-(2-piperidin-4-ylethyl)benzimidazol-4-yl]carbonylamino]butanoic acid dihydrobromide

Systemtic Name: 4-[[1-methyl-2-(2-piperidin-4-ylethyl)benzimidazol-4-yl]carbonylamino]butanoic acid dihydrobromide Openeye Name: 4-[[1-methyl-2-[2-(4-piperidyl)ethyl]benzimidazole-4-carbonyl]amino]butanoic acid dihydrobromide CAS Name: 4-[[[1-methyl-2-[2-(4-piperidinyl)ethyl]-4-benzimidazolyl]-oxomethyl]amino]butanoic acid dihydrobromide IUPAC Name: 4-[[1-methyl-2-(2-piperidin-4-ylethyl)benzimidazole-4-carbonyl]amino]butanoic acid dihydrobromide Traditional Name: 4-[[1-methyl-2-[2-(4-piperidyl)ethyl]benzimidazole-4-carbonyl]amino]butyric acid dihydrobromide Formula: C20H30Br2N4O3 MolecularWeight: 534.2852

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC(=C2N=C1CCC3CCNCC3)C(=O)NCCCC(=O)O.Br.Br

Isomeric SMILES

CN1C2=CC=CC(=C2N=C1CCC3CCNCC3)C(=O)NCCCC(=O)O.Br.Br

InChI

InChI=1S/C20H28N4O3.2BrH/c1-24-16-5-2-4-15(20(27)22-11-3-6-18(25)26)19(16)23-17(24)8-7-14-9-12-21-13-10-14;;/h2,4-5,14,21H,3,6-13H2,1H3,(H,22,27)(H,25,26);2*1H