4-(phenylmethyl)-1-(3-pyridin-3-ylpropanoyl)piperidine-4-carboxylic acid

Systemtic Name: 4-(phenylmethyl)-1-(3-pyridin-3-ylpropanoyl)piperidine-4-carboxylic acid Openeye Name: 4-benzyl-1-[3-(3-pyridyl)propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[1-oxo-3-(3-pyridinyl)propyl]-4-(phenylmethyl)-4-piperidinecarboxylic acid IUPAC Name: 4-benzyl-1-(3-pyridin-3-ylpropanoyl)piperidine-4-carboxylic acid Traditional Name: 4-benzyl-1-[3-(3-pyridyl)propanoyl]isonipecotic acid Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC2=CC=CC=C2)C(=O)O)C(=O)CCC3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1(CC2=CC=CC=C2)C(=O)O)C(=O)CCC3=CN=CC=C3

InChI

InChI=1S/C21H24N2O3/c24-19(9-8-18-7-4-12-22-16-18)23-13-10-21(11-14-23,20(25)26)15-17-5-2-1-3-6-17/h1-7,12,16H,8-11,13-15H2,(H,25,26)