2-[4-(2-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide

Systemtic Name: 2-[4-(2-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[4-(2-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[4-(2-chloro-4-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[4-(2-chloro-4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[4-(2-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-(5-methylisoxazol-3-yl)acetamide Formula: C16H19ClFN4O4S+ MolecularWeight: 417.862863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H18ClFN4O4S/c1-11-8-15(20-26-11)19-16(23)10-21-4-6-22(7-5-21)27(24,25)14-3-2-12(18)9-13(14)17/h2-3,8-9H,4-7,10H2,1H3,(H,19,20,23)/p+1