(2S)-2-(2-fluoranyl-4-nitro-phenyl)sulfanylpropanoate

Systemtic Name: (2S)-2-(2-fluoranyl-4-nitro-phenyl)sulfanylpropanoate Openeye Name: (2S)-2-(2-fluoro-4-nitro-phenyl)sulfanylpropanoate CAS Name: (2S)-2-[(2-fluoro-4-nitrophenyl)thio]propanoate IUPAC Name: (2S)-2-(2-fluoro-4-nitrophenyl)sulfanylpropanoate Traditional Name: (2S)-2-[(2-fluoro-4-nitro-phenyl)thio]propionate Formula: C9H7FNO4S- MolecularWeight: 244.219583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=C(C=C(C=C1)[N+](=O)[O-])F

Isomeric SMILES

C[C@@H](C(=O)[O-])SC1=C(C=C(C=C1)[N+](=O)[O-])F

InChI

InChI=1S/C9H8FNO4S/c1-5(9(12)13)16-8-3-2-6(11(14)15)4-7(8)10/h2-5H,1H3,(H,12,13)/p-1/t5-/m0/s1