3-(1,3-benzodioxol-5-ylsulfamoyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide

Systemtic Name: 3-(1,3-benzodioxol-5-ylsulfamoyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Openeye Name: 3-(1,3-benzodioxol-5-ylsulfamoyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide CAS Name: 3-(1,3-benzodioxol-5-ylsulfamoyl)-N-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]benzamide IUPAC Name: 3-(1,3-benzodioxol-5-ylsulfamoyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Traditional Name: 3-(1,3-benzodioxol-5-ylsulfamoyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Formula: C25H26N3O5S+ MolecularWeight: 480.55604

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H25N3O5S/c29-25(26-20-8-6-18(7-9-20)16-28-12-1-2-13-28)19-4-3-5-22(14-19)34(30,31)27-21-10-11-23-24(15-21)33-17-32-23/h3-11,14-15,27H,1-2,12-13,16-17H2,(H,26,29)/p+1