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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15F2N3O3S/c18-14-7-6-11(9-15(14)19)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