5-nitro-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoic acid

Systemtic Name: 5-nitro-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoic acid Openeye Name: 5-nitro-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoic acid CAS Name: 5-nitro-2-[[oxo-[3-(trifluoromethyl)anilino]methyl]amino]benzoic acid IUPAC Name: 5-nitro-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoic acid Traditional Name: 5-nitro-2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoic acid Formula: C15H10F3N3O5 MolecularWeight: 369.25221

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10F3N3O5/c16-15(17,18)8-2-1-3-9(6-8)19-14(24)20-12-5-4-10(21(25)26)7-11(12)13(22)23/h1-7H,(H,22,23)(H2,19,20,24)