1-[(1-ethylbenzimidazol-2-yl)-pyridin-3-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(1-ethylbenzimidazol-2-yl)-pyridin-3-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(1-ethylbenzimidazol-2-yl)-(3-pyridyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(1-ethyl-2-benzimidazolyl)-(3-pyridinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(1-ethylbenzimidazol-2-yl)-pyridin-3-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(1-ethylbenzimidazol-2-yl)-(3-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=CN=CC=C3)N4CCC(CC4)C(=O)O

Isomeric SMILES

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

InChI

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