N-[2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-4-ethanoyl-N-methyl-benzenesulfonamide

Systemtic Name: N-[2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-4-ethanoyl-N-methyl-benzenesulfonamide Openeye Name: 4-acetyl-N-[2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-4-ium-1-yl]-2-oxo-ethyl]-N-methyl-benzenesulfonamide CAS Name: 4-acetyl-N-[2-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazin-4-iumyl]-2-oxoethyl]-N-methylbenzenesulfonamide IUPAC Name: 4-acetyl-N-[2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-4-ium-1-yl]-2-oxoethyl]-N-methylbenzenesulfonamide Traditional Name: 4-acetyl-N-[2-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazin-4-ium-1-yl]-2-keto-ethyl]-N-methyl-benzenesulfonamide Formula: C23H35N4O5S+ MolecularWeight: 479.6128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)N2CC[NH+](CC2)CC(=O)N3CCCCCC3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)N2CC[NH+](CC2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C23H34N4O5S/c1-19(28)20-7-9-21(10-8-20)33(31,32)24(2)17-22(29)27-15-13-25(14-16-27)18-23(30)26-11-5-3-4-6-12-26/h7-10H,3-6,11-18H2,1-2H3/p+1