[4-[(1S)-1-azaniumylethyl]phenyl]sulfonyl-(2-bromanyl-4-fluoranyl-phenyl)azanide

Systemtic Name: [4-[(1S)-1-azaniumylethyl]phenyl]sulfonyl-(2-bromanyl-4-fluoranyl-phenyl)azanide Openeye Name: [4-[(1S)-1-azaniumylethyl]phenyl]sulfonyl-(2-bromo-4-fluoro-phenyl)azanide CAS Name: [4-[(1S)-1-ammonioethyl]phenyl]sulfonyl-(2-bromo-4-fluorophenyl)azanide IUPAC Name: [4-[(1S)-1-azaniumylethyl]phenyl]sulfonyl-(2-bromo-4-fluorophenyl)azanide Traditional Name: [4-[(1S)-1-ammonioethyl]phenyl]sulfonyl-(2-bromo-4-fluoro-phenyl)azanide Formula: C14H14BrFN2O2S MolecularWeight: 373.240563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrFN2O2S/c1-9(17)10-2-5-12(6-3-10)21(19,20)18-14-7-4-11(16)8-13(14)15/h2-9H,17H2,1H3/q-1/p+1/t9-/m0/s1