1-[(3-phenoxyphenyl)-pyridin-3-yl-methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3-phenoxyphenyl)-pyridin-3-yl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3-phenoxyphenyl)-(3-pyridyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(3-phenoxyphenyl)-(3-pyridinyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3-phenoxyphenyl)-pyridin-3-ylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[(3-phenoxyphenyl)-(3-pyridyl)methyl]nipecotic acid Formula: C24H24N2O3 MolecularWeight: 388.45896

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CN=CC=C4)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CN=CC=C4)C(=O)O

InChI

InChI=1S/C24H24N2O3/c27-24(28)20-9-6-14-26(17-20)23(19-8-5-13-25-16-19)18-7-4-12-22(15-18)29-21-10-2-1-3-11-21/h1-5,7-8,10-13,15-16,20,23H,6,9,14,17H2,(H,27,28)