2-[4-[3-(cyclopropylsulfamoyl)-4-methoxy-phenyl]carbonylpiperazin-1-ium-1-yl]-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-[4-[3-(cyclopropylsulfamoyl)-4-methoxy-phenyl]carbonylpiperazin-1-ium-1-yl]-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[4-[3-(cyclopropylsulfamoyl)-4-methoxy-benzoyl]piperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide CAS Name: 2-[4-[[3-(cyclopropylsulfamoyl)-4-methoxyphenyl]-oxomethyl]-1-piperazin-1-iumyl]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-[4-[3-(cyclopropylsulfamoyl)-4-methoxybenzoyl]piperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide Traditional Name: 2-[4-[3-(cyclopropylsulfamoyl)-4-methoxy-benzoyl]piperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide Formula: C23H28FN4O5S+ MolecularWeight: 491.555623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F)S(=O)(=O)NC4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F)S(=O)(=O)NC4CC4

InChI

InChI=1S/C23H27FN4O5S/c1-33-20-8-5-16(13-21(20)34(31,32)26-18-6-7-18)23(30)28-11-9-27(10-12-28)15-22(29)25-19-4-2-3-17(24)14-19/h2-5,8,13-14,18,26H,6-7,9-12,15H2,1H3,(H,25,29)/p+1