3-[[1-cyclohexyl-2-(2-piperidin-4-ylethyl)benzimidazol-4-yl]carbonylamino]propanoic acid dihydrobromide

Systemtic Name: 3-[[1-cyclohexyl-2-(2-piperidin-4-ylethyl)benzimidazol-4-yl]carbonylamino]propanoic acid dihydrobromide Openeye Name: 3-[[1-cyclohexyl-2-[2-(4-piperidyl)ethyl]benzimidazole-4-carbonyl]amino]propanoic acid dihydrobromide CAS Name: 3-[[[1-cyclohexyl-2-[2-(4-piperidinyl)ethyl]-4-benzimidazolyl]-oxomethyl]amino]propanoic acid dihydrobromide IUPAC Name: 3-[[1-cyclohexyl-2-(2-piperidin-4-ylethyl)benzimidazole-4-carbonyl]amino]propanoic acid dihydrobromide Traditional Name: 3-[[1-cyclohexyl-2-[2-(4-piperidyl)ethyl]benzimidazole-4-carbonyl]amino]propionic acid dihydrobromide Formula: C24H36Br2N4O3 MolecularWeight: 588.37564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=CC=CC(=C3N=C2CCC4CCNCC4)C(=O)NCCC(=O)O.Br.Br

Isomeric SMILES

C1CCC(CC1)N2C3=CC=CC(=C3N=C2CCC4CCNCC4)C(=O)NCCC(=O)O.Br.Br

InChI

InChI=1S/C24H34N4O3.2BrH/c29-22(30)13-16-26-24(31)19-7-4-8-20-23(19)27-21(10-9-17-11-14-25-15-12-17)28(20)18-5-2-1-3-6-18;;/h4,7-8,17-18,25H,1-3,5-6,9-16H2,(H,26,31)(H,29,30);2*1H