1-[(4-bromophenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane

Systemtic Name: 1-[(4-bromophenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Openeye Name: 1-[(4-bromophenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane CAS Name: 1-[(4-bromophenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane IUPAC Name: 1-[(4-bromophenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Traditional Name: 1-[(4-bromophenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Formula: C19H20BrF3N2 MolecularWeight: 413.27471

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC=C(C=C2)Br)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CNCCN(C1)C(C2=CC=C(C=C2)Br)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H20BrF3N2/c20-17-7-5-14(6-8-17)18(25-11-2-9-24-10-12-25)15-3-1-4-16(13-15)19(21,22)23/h1,3-8,13,18,24H,2,9-12H2