1-[(4-bromophenyl)-[2-chloranyl-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane

Systemtic Name: 1-[(4-bromophenyl)-[2-chloranyl-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Openeye Name: 1-[(4-bromophenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane CAS Name: 1-[(4-bromophenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane IUPAC Name: 1-[(4-bromophenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Traditional Name: 1-[(4-bromophenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Formula: C19H19BrClF3N2 MolecularWeight: 447.71977

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrClF3N2/c20-15-5-2-13(3-6-15)18(26-10-1-8-25-9-11-26)16-12-14(19(22,23)24)4-7-17(16)21/h2-7,12,18,25H,1,8-11H2