3-[[(1,3-dimethyl-2H-benzimidazol-2-yl)-(piperidin-4-ylmethyl)carbamoyl]amino]propanoic acid dihydrobromide

Systemtic Name: 3-[[(1,3-dimethyl-2H-benzimidazol-2-yl)-(piperidin-4-ylmethyl)carbamoyl]amino]propanoic acid dihydrobromide Openeye Name: 3-[[(1,3-dimethyl-2H-benzimidazol-2-yl)-(4-piperidylmethyl)carbamoyl]amino]propanoic acid dihydrobromide CAS Name: 3-[[[(1,3-dimethyl-2H-benzimidazol-2-yl)-(4-piperidinylmethyl)amino]-oxomethyl]amino]propanoic acid dihydrobromide IUPAC Name: 3-[[(1,3-dimethyl-2H-benzimidazol-2-yl)-(piperidin-4-ylmethyl)carbamoyl]amino]propanoic acid dihydrobromide Traditional Name: 3-[[(1,3-dimethyl-2H-benzimidazol-2-yl)-(4-piperidylmethyl)carbamoyl]amino]propionic acid dihydrobromide Formula: C19H31Br2N5O3 MolecularWeight: 537.28914

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(N(C2=CC=CC=C21)C)N(CC3CCNCC3)C(=O)NCCC(=O)O.Br.Br

Isomeric SMILES

CN1C(N(C2=CC=CC=C21)C)N(CC3CCNCC3)C(=O)NCCC(=O)O.Br.Br

InChI

InChI=1S/C19H29N5O3.2BrH/c1-22-15-5-3-4-6-16(15)23(2)19(22)24(13-14-7-10-20-11-8-14)18(27)21-12-9-17(25)26;;/h3-6,14,19-20H,7-13H2,1-2H3,(H,21,27)(H,25,26);2*1H