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

Systemtic Name: 2-azanyl-3-[(4-fluoranyl-3-nitro-phenyl)amino]-3-oxidanylidene-propanoic acid Openeye Name: 2-amino-3-(4-fluoro-3-nitro-anilino)-3-oxo-propanoic acid CAS Name: 2-amino-3-(4-fluoro-3-nitroanilino)-3-oxopropanoic acid IUPAC Name: 2-amino-3-(4-fluoro-3-nitroanilino)-3-oxopropanoic acid Traditional Name: 2-amino-3-(4-fluoro-3-nitro-anilino)-3-keto-propionic acid Formula: C9H8FN3O5 MolecularWeight: 257.175323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)C(C(=O)O)N)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)C(C(=O)O)N)[N+](=O)[O-])F

InChI

InChI=1S/C9H8FN3O5/c10-5-2-1-4(3-6(5)13(17)18)12-8(14)7(11)9(15)16/h1-3,7H,11H2,(H,12,14)(H,15,16)