1-(2-phenoxyethyl)-4-[[4-(trifluoromethyloxy)phenyl]methyl]-1,4-diazepan-5-one

Systemtic Name: 1-(2-phenoxyethyl)-4-[[4-(trifluoromethyloxy)phenyl]methyl]-1,4-diazepan-5-one Openeye Name: 1-(2-phenoxyethyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]-1,4-diazepan-5-one CAS Name: 1-(2-phenoxyethyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]-1,4-diazepan-5-one IUPAC Name: 1-(2-phenoxyethyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]-1,4-diazepan-5-one Traditional Name: 1-(2-phenoxyethyl)-4-[4-(trifluoromethoxy)benzyl]-1,4-diazepan-5-one Formula: C21H23F3N2O3 MolecularWeight: 408.41413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CC2=CC=C(C=C2)OC(F)(F)F)CCOC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1=O)CC2=CC=C(C=C2)OC(F)(F)F)CCOC3=CC=CC=C3

InChI

InChI=1S/C21H23F3N2O3/c22-21(23,24)29-19-8-6-17(7-9-19)16-26-13-12-25(11-10-20(26)27)14-15-28-18-4-2-1-3-5-18/h1-9H,10-16H2