2-[4-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-1,4-diazepan-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-1,4-diazepan-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-[(3-chloro-4-fluoro-phenyl)methyl]-1,4-diazepan-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[(3-chloro-4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-phenylacetamide IUPAC Name: 2-[4-[(3-chloro-4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-phenylacetamide Traditional Name: 2-[4-(3-chloro-4-fluoro-benzyl)-1,4-diazepan-1-yl]-N-phenyl-acetamide Formula: C20H23ClFN3O MolecularWeight: 375.867523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC(=O)NC2=CC=CC=C2)CC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN(C1)CC(=O)NC2=CC=CC=C2)CC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H23ClFN3O/c21-18-13-16(7-8-19(18)22)14-24-9-4-10-25(12-11-24)15-20(26)23-17-5-2-1-3-6-17/h1-3,5-8,13H,4,9-12,14-15H2,(H,23,26)