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

Systemtic Name: N-methyl-4-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-methyl-4-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-1-carbonyl]benzenesulfonamide CAS Name: N-methyl-4-[oxo-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazin-4-iumyl]methyl]benzenesulfonamide IUPAC Name: N-methyl-4-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-1-carbonyl]benzenesulfonamide Traditional Name: 4-[4-(2-keto-2-piperidino-ethyl)piperazin-4-ium-1-carbonyl]-N-methyl-benzenesulfonamide Formula: C19H29N4O4S+ MolecularWeight: 409.52296

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)N3CCCCC3

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)N3CCCCC3

InChI

InChI=1S/C19H28N4O4S/c1-20-28(26,27)17-7-5-16(6-8-17)19(25)23-13-11-21(12-14-23)15-18(24)22-9-3-2-4-10-22/h5-8,20H,2-4,9-15H2,1H3/p+1