N-(4-bromanyl-2-fluoranyl-phenyl)azepane-1-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)azepane-1-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)azepane-1-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-azepanecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)azepane-1-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)azepane-1-carboxamide Formula: C13H16BrFN2O MolecularWeight: 315.181343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1CCCN(CC1)C(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C13H16BrFN2O/c14-10-5-6-12(11(15)9-10)16-13(18)17-7-3-1-2-4-8-17/h5-6,9H,1-4,7-8H2,(H,16,18)