1-[(2,4-dinitrophenyl)amino]-3-[3-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[(2,4-dinitrophenyl)amino]-3-[3-(trifluoromethyl)phenyl]urea Openeye Name: 1-(2,4-dinitroanilino)-3-[3-(trifluoromethyl)phenyl]urea CAS Name: 1-(2,4-dinitroanilino)-3-[3-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(2,4-dinitroanilino)-3-[3-(trifluoromethyl)phenyl]urea Traditional Name: 1-(2,4-dinitroanilino)-3-[3-(trifluoromethyl)phenyl]urea Formula: C14H10F3N5O5 MolecularWeight: 385.25491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C14H10F3N5O5/c15-14(16,17)8-2-1-3-9(6-8)18-13(23)20-19-11-5-4-10(21(24)25)7-12(11)22(26)27/h1-7,19H,(H2,18,20,23)