[1-[[(5-bromanyl-2-fluoranyl-phenyl)carbonylamino]methyl]cycloheptyl]-dimethyl-azanium

Systemtic Name: [1-[[(5-bromanyl-2-fluoranyl-phenyl)carbonylamino]methyl]cycloheptyl]-dimethyl-azanium Openeye Name: [1-[[(5-bromo-2-fluoro-benzoyl)amino]methyl]cycloheptyl]-dimethyl-ammonium CAS Name: [1-[[[(5-bromo-2-fluorophenyl)-oxomethyl]amino]methyl]cycloheptyl]-dimethylammonium IUPAC Name: [1-[[(5-bromo-2-fluorobenzoyl)amino]methyl]cycloheptyl]-dimethylazanium Traditional Name: [1-[[(5-bromo-2-fluoro-benzoyl)amino]methyl]cycloheptyl]-dimethyl-ammonium Formula: C17H25BrFN2O+ MolecularWeight: 372.295603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1(CCCCCC1)CNC(=O)C2=C(C=CC(=C2)Br)F

Isomeric SMILES

C[NH+](C)C1(CCCCCC1)CNC(=O)C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C17H24BrFN2O/c1-21(2)17(9-5-3-4-6-10-17)12-20-16(22)14-11-13(18)7-8-15(14)19/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,20,22)/p+1