(4-bromanyl-3-fluoranyl-phenyl)-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone

Systemtic Name: (4-bromanyl-3-fluoranyl-phenyl)-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone Openeye Name: (4-bromo-3-fluoro-phenyl)-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone CAS Name: (4-bromo-3-fluorophenyl)-[(2S)-2-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]methanone IUPAC Name: (4-bromo-3-fluorophenyl)-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone Traditional Name: (4-bromo-3-fluoro-phenyl)-[(2S)-2-(pyrrolidinomethyl)pyrrolidino]methanone Formula: C16H20BrFN2O MolecularWeight: 355.245203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2CCCN2C(=O)C3=CC(=C(C=C3)Br)F

Isomeric SMILES

C1CCN(C1)C[C@@H]2CCCN2C(=O)C3=CC(=C(C=C3)Br)F

InChI

InChI=1S/C16H20BrFN2O/c17-14-6-5-12(10-15(14)18)16(21)20-9-3-4-13(20)11-19-7-1-2-8-19/h5-6,10,13H,1-4,7-9,11H2/t13-/m0/s1