2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-1-(furan-2-yl)ethanone

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-1-(furan-2-yl)ethanone Openeye Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-1-(2-furyl)ethanone CAS Name: 2-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazin-1-iumyl]-1-(2-furanyl)ethanone IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-1-(furan-2-yl)ethanone Traditional Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]-1-(2-furyl)ethanone Formula: C18H23N2O6S+ MolecularWeight: 395.45002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)C3=CC=CO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)C3=CC=CO3)OC

InChI

InChI=1S/C18H22N2O6S/c1-24-17-6-5-14(12-18(17)25-2)27(22,23)20-9-7-19(8-10-20)13-15(21)16-4-3-11-26-16/h3-6,11-12H,7-10,13H2,1-2H3/p+1