sodium 2-[(4-fluoranyl-5-methyl-2-nitro-phenyl)amino]ethanoic acid

Systemtic Name: sodium 2-[(4-fluoranyl-5-methyl-2-nitro-phenyl)amino]ethanoic acid Openeye Name: sodium 2-(4-fluoro-5-methyl-2-nitro-anilino)acetic acid CAS Name: sodium 2-(4-fluoro-5-methyl-2-nitroanilino)acetic acid IUPAC Name: sodium 2-(4-fluoro-5-methyl-2-nitroanilino)acetic acid Traditional Name: sodium 2-(4-fluoro-5-methyl-2-nitro-anilino)acetic acid Formula: C9H9FN2NaO4+ MolecularWeight: 251.166933

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1F)[N+](=O)[O-])NCC(=O)O.[Na+]

Isomeric SMILES

CC1=CC(=C(C=C1F)[N+](=O)[O-])NCC(=O)O.[Na+]

InChI

InChI=1S/C9H9FN2O4.Na/c1-5-2-7(11-4-9(13)14)8(12(15)16)3-6(5)10;/h2-3,11H,4H2,1H3,(H,13,14);/q;+1