N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2,5-bis(fluoranyl)benzamide

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2,5-bis(fluoranyl)benzamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2,5-difluoro-benzamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2,5-difluorobenzamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2,5-difluorobenzamide Traditional Name: 2,5-difluoro-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]benzamide Formula: C17H16F2N3O3S+ MolecularWeight: 380.389046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=C(C=CC(=C3)F)F

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C17H15F2N3O3S/c18-11-6-7-15(19)14(9-11)17(23)21-12-3-1-4-13(10-12)26(24,25)22-16-5-2-8-20-16/h1,3-4,6-7,9-10H,2,5,8H2,(H,20,22)(H,21,23)/p+1