1-[(4-bromanyl-1H-pyrrol-2-yl)carbonyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-bromanyl-1H-pyrrol-2-yl)carbonyl]piperidine-4-carboxylic acid Openeye Name: 1-(4-bromo-1H-pyrrole-2-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(4-bromo-1H-pyrrol-2-yl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(4-bromo-1H-pyrrole-2-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(4-bromo-1H-pyrrole-2-carbonyl)isonipecotic acid Formula: C11H13BrN2O3 MolecularWeight: 301.13652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)C2=CC(=CN2)Br

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C11H13BrN2O3/c12-8-5-9(13-6-8)10(15)14-3-1-7(2-4-14)11(16)17/h5-7,13H,1-4H2,(H,16,17)