2-azanyl-3-[(5-fluoranyl-2-nitro-phenyl)methylsulfanyl]propanoic acid

Systemtic Name: 2-azanyl-3-[(5-fluoranyl-2-nitro-phenyl)methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[(5-fluoro-2-nitro-phenyl)methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[(5-fluoro-2-nitrophenyl)methylthio]propanoic acid IUPAC Name: 2-amino-3-[(5-fluoro-2-nitrophenyl)methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[(5-fluoro-2-nitro-benzyl)thio]propionic acid Formula: C10H11FN2O4S MolecularWeight: 274.268743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11FN2O4S/c11-7-1-2-9(13(16)17)6(3-7)4-18-5-8(12)10(14)15/h1-3,8H,4-5,12H2,(H,14,15)