3-methyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 3-methyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]-N-propan-2-yl-benzenesulfonamide Openeye Name: N-isopropyl-3-methyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]benzenesulfonamide CAS Name: 3-methyl-4-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethoxy]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 3-methyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethoxy]-N-propan-2-ylbenzenesulfonamide Traditional Name: N-isopropyl-4-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethoxy]-3-methyl-benzenesulfonamide Formula: C17H28N3O4S+ MolecularWeight: 370.48692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O4S/c1-13(2)18-25(22,23)15-5-6-16(14(3)11-15)24-12-17(21)20-9-7-19(4)8-10-20/h5-6,11,13,18H,7-10,12H2,1-4H3/p+1