1-[1-(5-bromanylthiophen-2-yl)-2-pyridin-2-yl-ethyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[1-(5-bromanylthiophen-2-yl)-2-pyridin-2-yl-ethyl]piperidine-2-carboxylic acid Openeye Name: 1-[1-(5-bromo-2-thienyl)-2-(2-pyridyl)ethyl]piperidine-2-carboxylic acid CAS Name: 1-[1-(5-bromo-2-thiophenyl)-2-(2-pyridinyl)ethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[1-(5-bromothiophen-2-yl)-2-pyridin-2-ylethyl]piperidine-2-carboxylic acid Traditional Name: 1-[1-(5-bromo-2-thienyl)-2-(2-pyridyl)ethyl]pipecolinic acid Formula: C17H19BrN2O2S MolecularWeight: 395.31396

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(CC2=CC=CC=N2)C3=CC=C(S3)Br

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(CC2=CC=CC=N2)C3=CC=C(S3)Br

InChI

InChI=1S/C17H19BrN2O2S/c18-16-8-7-15(23-16)14(11-12-5-1-3-9-19-12)20-10-4-2-6-13(20)17(21)22/h1,3,5,7-9,13-14H,2,4,6,10-11H2,(H,21,22)