1-[(1-ethylbenzimidazol-2-yl)-pyridin-4-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(1-ethylbenzimidazol-2-yl)-pyridin-4-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(1-ethylbenzimidazol-2-yl)-(4-pyridyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(1-ethyl-2-benzimidazolyl)-pyridin-4-ylmethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(1-ethylbenzimidazol-2-yl)-pyridin-4-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(1-ethylbenzimidazol-2-yl)-(4-pyridyl)methyl]isonipecotic acid Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1C(C3=CC=NC=C3)N4CCC(CC4)C(=O)O

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1C(C3=CC=NC=C3)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C21H24N4O2/c1-2-25-18-6-4-3-5-17(18)23-20(25)19(15-7-11-22-12-8-15)24-13-9-16(10-14-24)21(26)27/h3-8,11-12,16,19H,2,9-10,13-14H2,1H3,(H,26,27)