3-fluoranyl-4-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]aniline

Systemtic Name: 3-fluoranyl-4-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]aniline Openeye Name: 3-fluoro-4-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]aniline CAS Name: 3-fluoro-4-[(4-methoxy-3-nitrophenyl)methylthio]aniline IUPAC Name: 3-fluoro-4-[(4-methoxy-3-nitrophenyl)methylsulfanyl]aniline Traditional Name: [3-fluoro-4-[(4-methoxy-3-nitro-benzyl)thio]phenyl]amine Formula: C14H13FN2O3S MolecularWeight: 308.328023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=C(C=C(C=C2)N)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=C(C=C(C=C2)N)F)[N+](=O)[O-]

InChI

InChI=1S/C14H13FN2O3S/c1-20-13-4-2-9(6-12(13)17(18)19)8-21-14-5-3-10(16)7-11(14)15/h2-7H,8,16H2,1H3