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

Systemtic Name: 1-[(4-methoxyphenyl)-(1-methylbenzimidazol-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-methoxyphenyl)-(1-methylbenzimidazol-2-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-methoxyphenyl)-(1-methyl-2-benzimidazolyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-methoxyphenyl)-(1-methylbenzimidazol-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-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=C(C=C3)OC)N4CCC(CC4)C(=O)O

Isomeric SMILES

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

InChI

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