2-[4-(5-bromanylpyridin-3-yl)carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(5-bromanylpyridin-3-yl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(5-bromopyridine-3-carbonyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(5-bromo-3-pyridinyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(5-bromopyridine-3-carbonyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(5-bromonicotinoyl)piperazino]acetic acid Formula: C12H14BrN3O3 MolecularWeight: 328.16186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C1CN(CCN1CC(=O)O)C(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C12H14BrN3O3/c13-10-5-9(6-14-7-10)12(19)16-3-1-15(2-4-16)8-11(17)18/h5-7H,1-4,8H2,(H,17,18)