4-[(5-fluoranyl-2-nitro-phenyl)methylsulfanyl]aniline

Systemtic Name: 4-[(5-fluoranyl-2-nitro-phenyl)methylsulfanyl]aniline Openeye Name: 4-[(5-fluoro-2-nitro-phenyl)methylsulfanyl]aniline CAS Name: 4-[(5-fluoro-2-nitrophenyl)methylthio]aniline IUPAC Name: 4-[(5-fluoro-2-nitrophenyl)methylsulfanyl]aniline Traditional Name: [4-[(5-fluoro-2-nitro-benzyl)thio]phenyl]amine Formula: C13H11FN2O2S MolecularWeight: 278.302043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)SCC2=C(C=CC(=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N)SCC2=C(C=CC(=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C13H11FN2O2S/c14-10-1-6-13(16(17)18)9(7-10)8-19-12-4-2-11(15)3-5-12/h1-7H,8,15H2