3-[(4-fluoranyl-2-nitro-phenyl)amino]-2-iodanyl-propanoic acid

Systemtic Name: 3-[(4-fluoranyl-2-nitro-phenyl)amino]-2-iodanyl-propanoic acid Openeye Name: 3-(4-fluoro-2-nitro-anilino)-2-iodo-propanoic acid CAS Name: 3-(4-fluoro-2-nitroanilino)-2-iodopropanoic acid IUPAC Name: 3-(4-fluoro-2-nitroanilino)-2-iodopropanoic acid Traditional Name: 3-(4-fluoro-2-nitro-anilino)-2-iodo-propionic acid Formula: C9H8FIN2O4 MolecularWeight: 354.073693

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8FIN2O4/c10-5-1-2-7(8(3-5)13(16)17)12-4-6(11)9(14)15/h1-3,6,12H,4H2,(H,14,15)