1-[[2,3-bis(fluoranyl)phenyl]methyl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[2,3-bis(fluoranyl)phenyl]methyl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2,3-difluorophenyl)methyl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(2,3-difluorophenyl)methyl]-N-(4-sulfamoylphenyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2,3-difluorophenyl)methyl]-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(2,3-difluorobenzyl)-N-(4-sulfamoylphenyl)piperidin-1-ium-4-carboxamide Formula: C19H22F2N3O3S+ MolecularWeight: 410.458086

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)CC3=C(C(=CC=C3)F)F

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N)CC3=C(C(=CC=C3)F)F

InChI

InChI=1S/C19H21F2N3O3S/c20-17-3-1-2-14(18(17)21)12-24-10-8-13(9-11-24)19(25)23-15-4-6-16(7-5-15)28(22,26)27/h1-7,13H,8-12H2,(H,23,25)(H2,22,26,27)/p+1