2-[[3-(azaniumylmethyl)-4-fluoranyl-phenyl]sulfonylamino]benzenecarboximidate

Systemtic Name: 2-[[3-(azaniumylmethyl)-4-fluoranyl-phenyl]sulfonylamino]benzenecarboximidate Openeye Name: 2-[[3-(azaniumylmethyl)-4-fluoro-phenyl]sulfonylamino]benzenecarboximidate CAS Name: 2-[[3-(ammoniomethyl)-4-fluorophenyl]sulfonylamino]benzenecarboximidate IUPAC Name: 2-[[3-(azaniumylmethyl)-4-fluorophenyl]sulfonylamino]benzenecarboximidate Traditional Name: 2-[[3-(ammoniomethyl)-4-fluoro-phenyl]sulfonylamino]benzenecarboximidate Formula: C14H14FN3O3S MolecularWeight: 323.342663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=N)[O-])NS(=O)(=O)C2=CC(=C(C=C2)F)C[NH3+]

Isomeric SMILES

C1=CC=C(C(=C1)C(=N)[O-])NS(=O)(=O)C2=CC(=C(C=C2)F)C[NH3+]

InChI

InChI=1S/C14H14FN3O3S/c15-12-6-5-10(7-9(12)8-16)22(20,21)18-13-4-2-1-3-11(13)14(17)19/h1-7,18H,8,16H2,(H2,17,19)