2-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide

Systemtic Name: 2-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Openeye Name: 2-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide CAS Name: 2-methyl-5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]benzamide IUPAC Name: 2-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzamide Traditional Name: 2-methyl-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Formula: C13H20N3O3S+ MolecularWeight: 298.3812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O3S/c1-10-3-4-11(9-12(10)13(14)17)20(18,19)16-7-5-15(2)6-8-16/h3-4,9H,5-8H2,1-2H3,(H2,14,17)/p+1