1-[4-methyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]ethanone

Systemtic Name: 1-[4-methyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]ethanone Openeye Name: 1-[4-methyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]ethanone CAS Name: 1-[4-methyl-3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-methyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanone Traditional Name: 1-[4-methyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]ethanone Formula: C14H21N2O3S+ MolecularWeight: 297.39314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O3S/c1-11-4-5-13(12(2)17)10-14(11)20(18,19)16-8-6-15(3)7-9-16/h4-5,10H,6-9H2,1-3H3/p+1