N-methyl-2-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]ethanamide

Systemtic Name: N-methyl-2-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: N-methyl-2-[[2-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]acetyl]amino]acetamide CAS Name: N-methyl-2-[[2-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]-1-oxoethyl]amino]acetamide IUPAC Name: N-methyl-2-[[2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]amino]acetamide Traditional Name: N-methyl-2-[[2-(4-tosylpiperazin-1-ium-1-yl)acetyl]amino]acetamide Formula: C16H25N4O4S+ MolecularWeight: 369.4591

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N4O4S/c1-13-3-5-14(6-4-13)25(23,24)20-9-7-19(8-10-20)12-16(22)18-11-15(21)17-2/h3-6H,7-12H2,1-2H3,(H,17,21)(H,18,22)/p+1