1-[(3-bromophenyl)-[2-chloranyl-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane

Systemtic Name: 1-[(3-bromophenyl)-[2-chloranyl-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Openeye Name: 1-[(3-bromophenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane CAS Name: 1-[(3-bromophenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane IUPAC Name: 1-[(3-bromophenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Traditional Name: 1-[(3-bromophenyl)-[2-chloro-5-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Formula: C19H19BrClF3N2 MolecularWeight: 447.71977

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrClF3N2/c20-15-4-1-3-13(11-15)18(26-9-2-7-25-8-10-26)16-12-14(19(22,23)24)5-6-17(16)21/h1,3-6,11-12,18,25H,2,7-10H2