1-(4-methylpiperidin-1-yl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-methylpiperidin-1-yl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone Openeye Name: 1-(4-methyl-1-piperidyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone CAS Name: 1-(4-methyl-1-piperidinyl)-2-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-(4-methylpiperidin-1-yl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone Traditional Name: 2-(4-mesitylsulfonylpiperazin-1-ium-1-yl)-1-(4-methylpiperidino)ethanone Formula: C21H34N3O3S+ MolecularWeight: 408.57796

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3C)C)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C21H33N3O3S/c1-16-5-7-23(8-6-16)20(25)15-22-9-11-24(12-10-22)28(26,27)21-18(3)13-17(2)14-19(21)4/h13-14,16H,5-12,15H2,1-4H3/p+1