2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-(3-nitrophenyl)acetamide CAS Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[4-(4-fluorobenzyl)-1,4-diazepan-1-yl]-N-(3-nitrophenyl)acetamide Formula: C20H23FN4O3 MolecularWeight: 386.420023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN(C1)CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H23FN4O3/c21-17-7-5-16(6-8-17)14-23-9-2-10-24(12-11-23)15-20(26)22-18-3-1-4-19(13-18)25(27)28/h1,3-8,13H,2,9-12,14-15H2,(H,22,26)