2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(furan-2-ylmethylcarbamoyl)ethanamide

Systemtic Name: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(furan-2-ylmethylcarbamoyl)ethanamide Openeye Name: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-furylmethylcarbamoyl)acetamide CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[(2-furanylmethylamino)-oxomethyl]acetamide IUPAC Name: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(furan-2-ylmethylcarbamoyl)acetamide Traditional Name: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-furfurylcarbamoyl)acetamide Formula: C18H22ClN4O5S+ MolecularWeight: 441.90908

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H21ClN4O5S/c19-14-3-5-16(6-4-14)29(26,27)23-9-7-22(8-10-23)13-17(24)21-18(25)20-12-15-2-1-11-28-15/h1-6,11H,7-10,12-13H2,(H2,20,21,24,25)/p+1