1-(2,5-dimethylphenyl)-3-[4-nitro-2-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-(2,5-dimethylphenyl)-3-[4-nitro-2-(trifluoromethyl)phenyl]urea Openeye Name: 1-(2,5-dimethylphenyl)-3-[4-nitro-2-(trifluoromethyl)phenyl]urea CAS Name: 1-(2,5-dimethylphenyl)-3-[4-nitro-2-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(2,5-dimethylphenyl)-3-[4-nitro-2-(trifluoromethyl)phenyl]urea Traditional Name: 1-(2,5-dimethylphenyl)-3-[4-nitro-2-(trifluoromethyl)phenyl]urea Formula: C16H14F3N3O3 MolecularWeight: 353.29587

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14F3N3O3/c1-9-3-4-10(2)14(7-9)21-15(23)20-13-6-5-11(22(24)25)8-12(13)16(17,18)19/h3-8H,1-2H3,(H2,20,21,23)