2-[(5-fluoranyl-2-nitro-phenyl)methylsulfanyl]ethanamine

Systemtic Name: 2-[(5-fluoranyl-2-nitro-phenyl)methylsulfanyl]ethanamine Openeye Name: 2-[(5-fluoro-2-nitro-phenyl)methylsulfanyl]ethanamine CAS Name: 2-[(5-fluoro-2-nitrophenyl)methylthio]ethanamine IUPAC Name: 2-[(5-fluoro-2-nitrophenyl)methylsulfanyl]ethanamine Traditional Name: 2-[(5-fluoro-2-nitro-benzyl)thio]ethylamine Formula: C9H11FN2O2S MolecularWeight: 230.259243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)CSCCN)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1F)CSCCN)[N+](=O)[O-]

InChI

InChI=1S/C9H11FN2O2S/c10-8-1-2-9(12(13)14)7(5-8)6-15-4-3-11/h1-2,5H,3-4,6,11H2