1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanone

Systemtic Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanone Openeye Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanone CAS Name: 1-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanone Traditional Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanone Formula: C13H19N2O3S+ MolecularWeight: 283.36656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O3S/c1-11(16)12-3-5-13(6-4-12)19(17,18)15-9-7-14(2)8-10-15/h3-6H,7-10H2,1-2H3/p+1