1-[(4-imidazol-1-ylphenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(4-imidazol-1-ylphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(4-imidazol-1-ylphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[[4-(1-imidazolyl)phenyl]methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-imidazol-1-ylphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-(4-imidazol-1-ylbenzyl)nipecotic acid Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=C(C=C2)N3C=CN=C3)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CC2=CC=C(C=C2)N3C=CN=C3)C(=O)O

InChI

InChI=1S/C16H19N3O2/c20-16(21)14-2-1-8-18(11-14)10-13-3-5-15(6-4-13)19-9-7-17-12-19/h3-7,9,12,14H,1-2,8,10-11H2,(H,20,21)