N-[2-(azepan-1-yl)-5-chloranyl-phenyl]-2-(2-cyanophenoxy)ethanamide

Systemtic Name: N-[2-(azepan-1-yl)-5-chloranyl-phenyl]-2-(2-cyanophenoxy)ethanamide Openeye Name: N-[2-(azepan-1-yl)-5-chloro-phenyl]-2-(2-cyanophenoxy)acetamide CAS Name: N-[2-(1-azepanyl)-5-chlorophenyl]-2-(2-cyanophenoxy)acetamide IUPAC Name: N-[2-(azepan-1-yl)-5-chlorophenyl]-2-(2-cyanophenoxy)acetamide Traditional Name: N-[2-(azepan-1-yl)-5-chloro-phenyl]-2-(2-cyanophenoxy)acetamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)COC3=CC=CC=C3C#N

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)COC3=CC=CC=C3C#N

InChI

InChI=1S/C21H22ClN3O2/c22-17-9-10-19(25-11-5-1-2-6-12-25)18(13-17)24-21(26)15-27-20-8-4-3-7-16(20)14-23/h3-4,7-10,13H,1-2,5-6,11-12,15H2,(H,24,26)