[4-(pyridin-4-ylmethylsulfamoyl)phenyl]methylazanium

Systemtic Name: [4-(pyridin-4-ylmethylsulfamoyl)phenyl]methylazanium Openeye Name: [4-(4-pyridylmethylsulfamoyl)phenyl]methylammonium CAS Name: [4-(pyridin-4-ylmethylsulfamoyl)phenyl]methylammonium IUPAC Name: [4-(pyridin-4-ylmethylsulfamoyl)phenyl]methylazanium Traditional Name: [4-(4-pyridylmethylsulfamoyl)benzyl]ammonium Formula: C13H16N3O2S+ MolecularWeight: 278.35004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[NH3+])S(=O)(=O)NCC2=CC=NC=C2

Isomeric SMILES

C1=CC(=CC=C1C[NH3+])S(=O)(=O)NCC2=CC=NC=C2

InChI

InChI=1S/C13H15N3O2S/c14-9-11-1-3-13(4-2-11)19(17,18)16-10-12-5-7-15-8-6-12/h1-8,16H,9-10,14H2/p+1