2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-N-(4-ethanoylphenyl)propanamide

Systemtic Name: 2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-N-(4-ethanoylphenyl)propanamide Openeye Name: N-(4-acetylphenyl)-2-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]propanamide CAS Name: N-(4-acetylphenyl)-2-[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]propanamide IUPAC Name: N-(4-acetylphenyl)-2-[4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]propanamide Traditional Name: N-(4-acetylphenyl)-2-[4-(2-chloro-4-fluoro-benzyl)piperazino]propionamide Formula: C22H25ClFN3O2 MolecularWeight: 417.904203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)C)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)C)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C22H25ClFN3O2/c1-15(22(29)25-20-7-4-17(5-8-20)16(2)28)27-11-9-26(10-12-27)14-18-3-6-19(24)13-21(18)23/h3-8,13,15H,9-12,14H2,1-2H3,(H,25,29)