1-(2-phenoxyethyl)-4-[[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-5-one

Systemtic Name: 1-(2-phenoxyethyl)-4-[[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-5-one Openeye Name: 1-(2-phenoxyethyl)-4-[[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-5-one CAS Name: 1-(2-phenoxyethyl)-4-[[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-5-one IUPAC Name: 1-(2-phenoxyethyl)-4-[[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-5-one Traditional Name: 1-(2-phenoxyethyl)-4-[3-(trifluoromethyl)benzyl]-1,4-diazepan-5-one Formula: C21H23F3N2O2 MolecularWeight: 392.41473

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23F3N2O2/c22-21(23,24)18-6-4-5-17(15-18)16-26-12-11-25(10-9-20(26)27)13-14-28-19-7-2-1-3-8-19/h1-8,15H,9-14,16H2