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

Systemtic Name: 2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)ethanamide Openeye Name: 2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-methylisoxazol-5-yl)acetamide CAS Name: 2-[4-(4-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(3-methyl-5-isoxazolyl)acetamide IUPAC Name: 2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)acetamide Traditional Name: 2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-methylisoxazol-5-yl)acetamide Formula: C16H20FN4O4S+ MolecularWeight: 383.417803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NOC(=C1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H19FN4O4S/c1-12-10-16(25-19-12)18-15(22)11-20-6-8-21(9-7-20)26(23,24)14-4-2-13(17)3-5-14/h2-5,10H,6-9,11H2,1H3,(H,18,22)/p+1