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

Systemtic Name: 1-[(4-bromophenyl)-pyridin-3-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-bromophenyl)-(3-pyridyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(4-bromophenyl)-(3-pyridinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-bromophenyl)-pyridin-3-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-bromophenyl)-(3-pyridyl)methyl]pipecolinic acid Formula: C18H19BrN2O2 MolecularWeight: 375.25966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC=C(C=C2)Br)C3=CN=CC=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC=C(C=C2)Br)C3=CN=CC=C3

InChI

InChI=1S/C18H19BrN2O2/c19-15-8-6-13(7-9-15)17(14-4-3-10-20-12-14)21-11-2-1-5-16(21)18(22)23/h3-4,6-10,12,16-17H,1-2,5,11H2,(H,22,23)