2-chloranyl-N-cyclopropyl-5-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 2-chloranyl-N-cyclopropyl-5-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide Openeye Name: 2-chloro-N-cyclopropyl-5-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-4-ium-1-carbonyl]benzenesulfonamide CAS Name: 2-chloro-N-cyclopropyl-5-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazin-4-iumyl]-oxomethyl]benzenesulfonamide IUPAC Name: 2-chloro-N-cyclopropyl-5-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-4-ium-1-carbonyl]benzenesulfonamide Traditional Name: 2-chloro-5-[4-(coumaran-5-ylmethyl)piperazin-4-ium-1-carbonyl]-N-cyclopropyl-benzenesulfonamide Formula: C23H27ClN3O4S+ MolecularWeight: 476.99618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCC5)Cl

Isomeric SMILES

C1CC1NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCC5)Cl

InChI

InChI=1S/C23H26ClN3O4S/c24-20-5-2-18(14-22(20)32(29,30)25-19-3-4-19)23(28)27-10-8-26(9-11-27)15-16-1-6-21-17(13-16)7-12-31-21/h1-2,5-6,13-14,19,25H,3-4,7-12,15H2/p+1