2-(aminocarbonylamino)-4-nitro-6-[2-(trifluoromethyl)phenyl]benzoic acid

Systemtic Name: 2-(aminocarbonylamino)-4-nitro-6-[2-(trifluoromethyl)phenyl]benzoic acid Openeye Name: 4-nitro-2-[2-(trifluoromethyl)phenyl]-6-ureido-benzoic acid CAS Name: 2-(carbamoylamino)-4-nitro-6-[2-(trifluoromethyl)phenyl]benzoic acid IUPAC Name: 2-(carbamoylamino)-4-nitro-6-[2-(trifluoromethyl)phenyl]benzoic acid Traditional Name: 4-nitro-2-[2-(trifluoromethyl)phenyl]-6-ureido-benzoic acid Formula: C15H10F3N3O5 MolecularWeight: 369.25221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC(=CC(=C2C(=O)O)NC(=O)N)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC(=CC(=C2C(=O)O)NC(=O)N)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C15H10F3N3O5/c16-15(17,18)10-4-2-1-3-8(10)9-5-7(21(25)26)6-11(20-14(19)24)12(9)13(22)23/h1-6H,(H,22,23)(H3,19,20,24)