[5-(azaniumylmethyl)-2-fluoranyl-phenyl]sulfonyl-(4-cyanophenyl)azanide

Systemtic Name: [5-(azaniumylmethyl)-2-fluoranyl-phenyl]sulfonyl-(4-cyanophenyl)azanide Openeye Name: [5-(azaniumylmethyl)-2-fluoro-phenyl]sulfonyl-(4-cyanophenyl)azanide CAS Name: [5-(ammoniomethyl)-2-fluorophenyl]sulfonyl-(4-cyanophenyl)azanide IUPAC Name: [5-(azaniumylmethyl)-2-fluorophenyl]sulfonyl-(4-cyanophenyl)azanide Traditional Name: [5-(ammoniomethyl)-2-fluoro-phenyl]sulfonyl-(4-cyanophenyl)azanide Formula: C14H12FN3O2S MolecularWeight: 305.327383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)[N-]S(=O)(=O)C2=C(C=CC(=C2)C[NH3+])F

Isomeric SMILES

C1=CC(=CC=C1C#N)[N-]S(=O)(=O)C2=C(C=CC(=C2)C[NH3+])F

InChI

InChI=1S/C14H11FN3O2S/c15-13-6-3-11(9-17)7-14(13)21(19,20)18-12-4-1-10(8-16)2-5-12/h1-7H,9,17H2/q-1/p+1