2-chloranyl-5-morpholin-4-ylsulfonyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide

Systemtic Name: 2-chloranyl-5-morpholin-4-ylsulfonyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Openeye Name: 2-chloro-5-morpholinosulfonyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide CAS Name: 2-chloro-5-(4-morpholinylsulfonyl)-N-[3-(1-pyrrolidin-1-iumyl)propyl]benzamide IUPAC Name: 2-chloro-5-morpholin-4-ylsulfonyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Traditional Name: 2-chloro-5-morpholinosulfonyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Formula: C18H27ClN3O4S+ MolecularWeight: 416.94268

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

C1CC[NH+](C1)CCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C18H26ClN3O4S/c19-17-5-4-15(27(24,25)22-10-12-26-13-11-22)14-16(17)18(23)20-6-3-9-21-7-1-2-8-21/h4-5,14H,1-3,6-13H2,(H,20,23)/p+1