[3-(azaniumylmethyl)-4-fluoranyl-phenyl]sulfonyl-(3-ethanoylphenyl)azanide

Systemtic Name: [3-(azaniumylmethyl)-4-fluoranyl-phenyl]sulfonyl-(3-ethanoylphenyl)azanide Openeye Name: (3-acetylphenyl)-[3-(azaniumylmethyl)-4-fluoro-phenyl]sulfonyl-azanide CAS Name: (3-acetylphenyl)-[3-(ammoniomethyl)-4-fluorophenyl]sulfonylazanide IUPAC Name: (3-acetylphenyl)-[3-(azaniumylmethyl)-4-fluorophenyl]sulfonylazanide Traditional Name: (3-acetylphenyl)-[3-(ammoniomethyl)-4-fluoro-phenyl]sulfonyl-azanide Formula: C15H15FN2O3S MolecularWeight: 322.354603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14FN2O3S/c1-10(19)11-3-2-4-13(7-11)18-22(20,21)14-5-6-15(16)12(8-14)9-17/h2-8H,9,17H2,1H3/q-1/p+1