5-[(5-fluoranyl-2-methyl-phenyl)amino]-2-nitro-benzoic acid

Systemtic Name: 5-[(5-fluoranyl-2-methyl-phenyl)amino]-2-nitro-benzoic acid Openeye Name: 5-(5-fluoro-2-methyl-anilino)-2-nitro-benzoic acid CAS Name: 5-(5-fluoro-2-methylanilino)-2-nitrobenzoic acid IUPAC Name: 5-(5-fluoro-2-methylanilino)-2-nitrobenzoic acid Traditional Name: 5-(5-fluoro-2-methyl-anilino)-2-nitro-benzoic acid Formula: C14H11FN2O4 MolecularWeight: 290.246543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)F)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H11FN2O4/c1-8-2-3-9(15)6-12(8)16-10-4-5-13(17(20)21)11(7-10)14(18)19/h2-7,16H,1H3,(H,18,19)