1-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(1-phenyl-4-pyrazolyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(1-phenylpyrazol-4-yl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(1-phenylpyrazol-4-yl)methyl]nipecotic acid Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O2/c20-16(21)14-5-4-8-18(12-14)10-13-9-17-19(11-13)15-6-2-1-3-7-15/h1-3,6-7,9,11,14H,4-5,8,10,12H2,(H,20,21)