2-[4-(2-fluoranyl-2-phenyl-ethanoyl)-1,4-diazepan-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(2-fluoranyl-2-phenyl-ethanoyl)-1,4-diazepan-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(2-fluoro-2-phenyl-acetyl)-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-(2-fluoro-1-oxo-2-phenylethyl)-1,4-diazepan-1-yl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(2-fluoro-2-phenylacetyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(2-fluoro-2-phenyl-acetyl)-1,4-diazepan-1-yl]acetamide Formula: C22H26FN3O2 MolecularWeight: 383.459143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C(C2=CC=CC=C2)F)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)C(C2=CC=CC=C2)F)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H26FN3O2/c23-21(19-10-5-2-6-11-19)22(28)26-13-7-12-25(14-15-26)17-20(27)24-16-18-8-3-1-4-9-18/h1-6,8-11,21H,7,12-17H2,(H,24,27)