1-[(3-methoxyphenyl)-(1-methylbenzimidazol-2-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(3-methoxyphenyl)-(1-methylbenzimidazol-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3-methoxyphenyl)-(1-methylbenzimidazol-2-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3-methoxyphenyl)-(1-methyl-2-benzimidazolyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3-methoxyphenyl)-(1-methylbenzimidazol-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(3-methoxyphenyl)-(1-methylbenzimidazol-2-yl)methyl]isonipecotic acid Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(C3=CC(=CC=C3)OC)N4CCC(CC4)C(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C(C3=CC(=CC=C3)OC)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C22H25N3O3/c1-24-19-9-4-3-8-18(19)23-21(24)20(16-6-5-7-17(14-16)28-2)25-12-10-15(11-13-25)22(26)27/h3-9,14-15,20H,10-13H2,1-2H3,(H,26,27)