1-(5-bromanylpyridin-3-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(5-bromanylpyridin-3-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(5-bromopyridine-3-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(5-bromo-3-pyridinyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(5-bromopyridine-3-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(5-bromonicotinoyl)isonipecotic acid Formula: C12H13BrN2O3 MolecularWeight: 313.14722

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C12H13BrN2O3/c13-10-5-9(6-14-7-10)11(16)15-3-1-8(2-4-15)12(17)18/h5-8H,1-4H2,(H,17,18)