2-[4-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-[4-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[4-(5-chloro-2-methoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide CAS Name: 2-[4-(5-chloro-2-methoxyphenyl)sulfonyl-1-piperazin-1-iumyl]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-[4-(5-chloro-2-methoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide Traditional Name: 2-[4-(5-chloro-2-methoxy-phenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide Formula: C19H22ClFN3O4S+ MolecularWeight: 442.912083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C19H21ClFN3O4S/c1-28-17-6-5-14(20)11-18(17)29(26,27)24-9-7-23(8-10-24)13-19(25)22-16-4-2-3-15(21)12-16/h2-6,11-12H,7-10,13H2,1H3,(H,22,25)/p+1