1-[1-(3-bromophenyl)-2-pyridin-2-yl-ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1-(3-bromophenyl)-2-pyridin-2-yl-ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(3-bromophenyl)-2-(2-pyridyl)ethyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(3-bromophenyl)-2-(2-pyridinyl)ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-(3-bromophenyl)-2-pyridin-2-ylethyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(3-bromophenyl)-2-(2-pyridyl)ethyl]isonipecotic acid Formula: C19H21BrN2O2 MolecularWeight: 389.28624

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(CC2=CC=CC=N2)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCC1C(=O)O)C(CC2=CC=CC=N2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H21BrN2O2/c20-16-5-3-4-15(12-16)18(13-17-6-1-2-9-21-17)22-10-7-14(8-11-22)19(23)24/h1-6,9,12,14,18H,7-8,10-11,13H2,(H,23,24)