5-[1-methyl-2-(2-piperidin-4-ylethyl)benzimidazol-5-yl]-5-oxidanylidene-pentanoic acid dihydrobromide

Systemtic Name: 5-[1-methyl-2-(2-piperidin-4-ylethyl)benzimidazol-5-yl]-5-oxidanylidene-pentanoic acid dihydrobromide Openeye Name: 5-[1-methyl-2-[2-(4-piperidyl)ethyl]benzimidazol-5-yl]-5-oxo-pentanoic acid dihydrobromide CAS Name: 5-[1-methyl-2-[2-(4-piperidinyl)ethyl]-5-benzimidazolyl]-5-oxopentanoic acid dihydrobromide IUPAC Name: 5-[1-methyl-2-(2-piperidin-4-ylethyl)benzimidazol-5-yl]-5-oxopentanoic acid dihydrobromide Traditional Name: 5-keto-5-[1-methyl-2-[2-(4-piperidyl)ethyl]benzimidazol-5-yl]valeric acid dihydrobromide Formula: C20H29Br2N3O3 MolecularWeight: 519.27056

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)CCCC(=O)O)N=C1CCC3CCNCC3.Br.Br

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)CCCC(=O)O)N=C1CCC3CCNCC3.Br.Br

InChI

InChI=1S/C20H27N3O3.2BrH/c1-23-17-7-6-15(18(24)3-2-4-20(25)26)13-16(17)22-19(23)8-5-14-9-11-21-12-10-14;;/h6-7,13-14,21H,2-5,8-12H2,1H3,(H,25,26);2*1H