1-methyl-3-phenyl-1-[2,2,2-tris(fluoranyl)-1-isocyanato-ethyl]urea

Systemtic Name: 1-methyl-3-phenyl-1-[2,2,2-tris(fluoranyl)-1-isocyanato-ethyl]urea Openeye Name: 1-methyl-3-phenyl-1-(2,2,2-trifluoro-1-isocyanato-ethyl)urea CAS Name: 1-methyl-3-phenyl-1-(2,2,2-trifluoro-1-isocyanatoethyl)urea IUPAC Name: 1-methyl-3-phenyl-1-(2,2,2-trifluoro-1-isocyanatoethyl)urea Traditional Name: 1-methyl-3-phenyl-1-(2,2,2-trifluoro-1-isocyanato-ethyl)urea Formula: C11H10F3N3O2 MolecularWeight: 273.21121

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(C(F)(F)F)N=C=O)C(=O)NC1=CC=CC=C1

Isomeric SMILES

CN(C(C(F)(F)F)N=C=O)C(=O)NC1=CC=CC=C1

InChI

InChI=1S/C11H10F3N3O2/c1-17(9(15-7-18)11(12,13)14)10(19)16-8-5-3-2-4-6-8/h2-6,9H,1H3,(H,16,19)