2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: 2-[4-(2-chloro-4-fluoro-benzyl)piperazino]-N-mesityl-acetamide Formula: C22H27ClFN3O MolecularWeight: 403.920683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CN2CCN(CC2)CC3=C(C=C(C=C3)F)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CN2CCN(CC2)CC3=C(C=C(C=C3)F)Cl)C

InChI

InChI=1S/C22H27ClFN3O/c1-15-10-16(2)22(17(3)11-15)25-21(28)14-27-8-6-26(7-9-27)13-18-4-5-19(24)12-20(18)23/h4-5,10-12H,6-9,13-14H2,1-3H3,(H,25,28)