3-[(4-fluorophenyl)-nitroso-amino]benzoic acid

Systemtic Name: 3-[(4-fluorophenyl)-nitroso-amino]benzoic acid Openeye Name: 3-(4-fluoro-N-nitroso-anilino)benzoic acid CAS Name: 3-(4-fluoro-N-nitrosoanilino)benzoic acid IUPAC Name: 3-(4-fluoro-N-nitrosoanilino)benzoic acid Traditional Name: 3-(4-fluoro-N-nitroso-anilino)benzoic acid Formula: C13H9FN2O3 MolecularWeight: 260.220563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N(C2=CC=C(C=C2)F)N=O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N(C2=CC=C(C=C2)F)N=O)C(=O)O

InChI

InChI=1S/C13H9FN2O3/c14-10-4-6-11(7-5-10)16(15-19)12-3-1-2-9(8-12)13(17)18/h1-8H,(H,17,18)