1-[2-(3-bromanylphenoxy)ethanoyl]-7-(trifluoromethyl)-1,4-diazepan-5-one

Systemtic Name: 1-[2-(3-bromanylphenoxy)ethanoyl]-7-(trifluoromethyl)-1,4-diazepan-5-one Openeye Name: 1-[2-(3-bromophenoxy)acetyl]-7-(trifluoromethyl)-1,4-diazepan-5-one CAS Name: 1-[2-(3-bromophenoxy)-1-oxoethyl]-7-(trifluoromethyl)-1,4-diazepan-5-one IUPAC Name: 1-[2-(3-bromophenoxy)acetyl]-7-(trifluoromethyl)-1,4-diazepan-5-one Traditional Name: 1-[2-(3-bromophenoxy)acetyl]-7-(trifluoromethyl)-1,4-diazepan-5-one Formula: C14H14BrF3N2O3 MolecularWeight: 395.17177

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC(=O)N1)C(F)(F)F)C(=O)COC2=CC(=CC=C2)Br

Isomeric SMILES

C1CN(C(CC(=O)N1)C(F)(F)F)C(=O)COC2=CC(=CC=C2)Br

InChI

InChI=1S/C14H14BrF3N2O3/c15-9-2-1-3-10(6-9)23-8-13(22)20-5-4-19-12(21)7-11(20)14(16,17)18/h1-3,6,11H,4-5,7-8H2,(H,19,21)