2-chloranyl-N-[[(2R)-oxolan-2-yl]methyl]-5-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 2-chloranyl-N-[[(2R)-oxolan-2-yl]methyl]-5-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide Openeye Name: 5-(4-benzylpiperazin-4-ium-1-carbonyl)-2-chloro-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzenesulfonamide CAS Name: 2-chloro-N-[[(2R)-2-oxolanyl]methyl]-5-[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]benzenesulfonamide IUPAC Name: 5-(4-benzylpiperazin-4-ium-1-carbonyl)-2-chloro-N-[[(2R)-oxolan-2-yl]methyl]benzenesulfonamide Traditional Name: 5-(4-benzylpiperazin-4-ium-1-carbonyl)-2-chloro-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzenesulfonamide Formula: C23H29ClN3O4S+ MolecularWeight: 479.01206

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

C1C[C@@H](OC1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H28ClN3O4S/c24-21-9-8-19(15-22(21)32(29,30)25-16-20-7-4-14-31-20)23(28)27-12-10-26(11-13-27)17-18-5-2-1-3-6-18/h1-3,5-6,8-9,15,20,25H,4,7,10-14,16-17H2/p+1/t20-/m1/s1