N-[4-(azepan-1-yl)phenyl]-2-(5-fluoranyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-(5-fluoranyl-2-nitro-phenoxy)ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-(5-fluoro-2-nitro-phenoxy)acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-(5-fluoro-2-nitrophenoxy)acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-(5-fluoro-2-nitrophenoxy)acetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-(5-fluoro-2-nitro-phenoxy)acetamide Formula: C20H22FN3O4 MolecularWeight: 387.404783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H22FN3O4/c21-15-5-10-18(24(26)27)19(13-15)28-14-20(25)22-16-6-8-17(9-7-16)23-11-3-1-2-4-12-23/h5-10,13H,1-4,11-12,14H2,(H,22,25)