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

Systemtic Name: 1-piperidin-1-yl-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone Openeye Name: 1-(1-piperidyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone CAS Name: 1-(1-piperidinyl)-2-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-piperidin-1-yl-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanone Traditional Name: 2-(4-mesitylsulfonylpiperazin-1-ium-1-yl)-1-piperidino-ethanone Formula: C20H32N3O3S+ MolecularWeight: 394.55138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N3CCCCC3)C

InChI

InChI=1S/C20H31N3O3S/c1-16-13-17(2)20(18(3)14-16)27(25,26)23-11-9-21(10-12-23)15-19(24)22-7-5-4-6-8-22/h13-14H,4-12,15H2,1-3H3/p+1