1-(4-nitrophenyl)-3-[[4-[2,2,2-tris(fluoranyl)ethoxymethyl]phenyl]methyl]urea

Systemtic Name: 1-(4-nitrophenyl)-3-[[4-[2,2,2-tris(fluoranyl)ethoxymethyl]phenyl]methyl]urea Openeye Name: 1-(4-nitrophenyl)-3-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methyl]urea CAS Name: 1-(4-nitrophenyl)-3-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methyl]urea IUPAC Name: 1-(4-nitrophenyl)-3-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methyl]urea Traditional Name: 1-(4-nitrophenyl)-3-[4-(2,2,2-trifluoroethoxymethyl)benzyl]urea Formula: C17H16F3N3O4 MolecularWeight: 383.32185

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])COCC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])COCC(F)(F)F

InChI

InChI=1S/C17H16F3N3O4/c18-17(19,20)11-27-10-13-3-1-12(2-4-13)9-21-16(24)22-14-5-7-15(8-6-14)23(25)26/h1-8H,9-11H2,(H2,21,22,24)