1-[2-(2-phenylphenyl)ethanoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-(2-phenylphenyl)ethanoyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-(2-phenylphenyl)acetyl]piperidine-3-carboxylic acid CAS Name: 1-[1-oxo-2-(2-phenylphenyl)ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(2-phenylphenyl)acetyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(2-phenylphenyl)acetyl]nipecotic acid Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CC2=CC=CC=C2C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)CC2=CC=CC=C2C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H21NO3/c22-19(21-12-6-10-17(14-21)20(23)24)13-16-9-4-5-11-18(16)15-7-2-1-3-8-15/h1-5,7-9,11,17H,6,10,12-14H2,(H,23,24)