N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1-phenyl-cyclopentane-1-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1-phenyl-cyclopentane-1-carboxamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1-phenyl-cyclopentanecarboxamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1-phenyl-1-cyclopentanecarboxamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1-phenylcyclopentane-1-carboxamide Traditional Name: 1-phenyl-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]cyclopentanecarboxamide Formula: C22H26N3O3S+ MolecularWeight: 412.52514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)NC4=[NH+]CCC4

Isomeric SMILES

C1CCC(C1)(C2=CC=CC=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)NC4=[NH+]CCC4

InChI

InChI=1S/C22H25N3O3S/c26-21(22(13-4-5-14-22)17-8-2-1-3-9-17)24-18-10-6-11-19(16-18)29(27,28)25-20-12-7-15-23-20/h1-3,6,8-11,16H,4-5,7,12-15H2,(H,23,25)(H,24,26)/p+1