N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-2-(1,4-diazepan-1-yl)-2-oxidanylidene-ethanamide

Systemtic Name: N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-2-(1,4-diazepan-1-yl)-2-oxidanylidene-ethanamide Openeye Name: N-(2-bromo-4,6-difluoro-phenyl)-2-(1,4-diazepan-1-yl)-2-oxo-acetamide CAS Name: N-(2-bromo-4,6-difluorophenyl)-2-(1,4-diazepan-1-yl)-2-oxoacetamide IUPAC Name: N-(2-bromo-4,6-difluorophenyl)-2-(1,4-diazepan-1-yl)-2-oxoacetamide Traditional Name: N-(2-bromo-4,6-difluoro-phenyl)-2-(1,4-diazepan-1-yl)-2-keto-acetamide Formula: C13H14BrF2N3O2 MolecularWeight: 362.169966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C(=O)NC2=C(C=C(C=C2Br)F)F

Isomeric SMILES

C1CNCCN(C1)C(=O)C(=O)NC2=C(C=C(C=C2Br)F)F

InChI

InChI=1S/C13H14BrF2N3O2/c14-9-6-8(15)7-10(16)11(9)18-12(20)13(21)19-4-1-2-17-3-5-19/h6-7,17H,1-5H2,(H,18,20)