2-[4-fluoranyl-3-(pyridin-4-ylmethylsulfamoyl)phenyl]ethylazanium

Systemtic Name: 2-[4-fluoranyl-3-(pyridin-4-ylmethylsulfamoyl)phenyl]ethylazanium Openeye Name: 2-[4-fluoro-3-(4-pyridylmethylsulfamoyl)phenyl]ethylammonium CAS Name: 2-[4-fluoro-3-(pyridin-4-ylmethylsulfamoyl)phenyl]ethylammonium IUPAC Name: 2-[4-fluoro-3-(pyridin-4-ylmethylsulfamoyl)phenyl]ethylazanium Traditional Name: 2-[4-fluoro-3-(4-pyridylmethylsulfamoyl)phenyl]ethylammonium Formula: C14H17FN3O2S+ MolecularWeight: 310.367083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC[NH3+])S(=O)(=O)NCC2=CC=NC=C2)F

Isomeric SMILES

C1=CC(=C(C=C1CC[NH3+])S(=O)(=O)NCC2=CC=NC=C2)F

InChI

InChI=1S/C14H16FN3O2S/c15-13-2-1-11(3-6-16)9-14(13)21(19,20)18-10-12-4-7-17-8-5-12/h1-2,4-5,7-9,18H,3,6,10,16H2/p+1