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

Systemtic Name: 4-(2-phenoxyethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-5-one Openeye Name: 4-(2-phenoxyethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-5-one CAS Name: 4-(2-phenoxyethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-5-one IUPAC Name: 4-(2-phenoxyethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-5-one Traditional Name: 4-(2-phenoxyethyl)-1-[4-(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)CCOC2=CC=CC=C2)CC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN(C1=O)CCOC2=CC=CC=C2)CC3=CC=C(C=C3)C(F)(F)F

InChI

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