3-[(phenylmethyl)sulfamoyl]-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-[(phenylmethyl)sulfamoyl]-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-(benzylsulfamoyl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-[(phenylmethyl)sulfamoyl]-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-(benzylsulfamoyl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-(benzylsulfamoyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C26H30N3O3S+ MolecularWeight: 464.5997

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3S/c30-26(27-18-22-11-13-23(14-12-22)20-29-15-4-5-16-29)24-9-6-10-25(17-24)33(31,32)28-19-21-7-2-1-3-8-21/h1-3,6-14,17,28H,4-5,15-16,18-20H2,(H,27,30)/p+1