1-(4-butyl-2-methyl-phenyl)-3-[2,2,2-tris(fluoranyl)ethyl]urea

Systemtic Name: 1-(4-butyl-2-methyl-phenyl)-3-[2,2,2-tris(fluoranyl)ethyl]urea Openeye Name: 1-(4-butyl-2-methyl-phenyl)-3-(2,2,2-trifluoroethyl)urea CAS Name: 1-(4-butyl-2-methylphenyl)-3-(2,2,2-trifluoroethyl)urea IUPAC Name: 1-(4-butyl-2-methylphenyl)-3-(2,2,2-trifluoroethyl)urea Traditional Name: 1-(4-butyl-2-methyl-phenyl)-3-(2,2,2-trifluoroethyl)urea Formula: C14H19F3N2O MolecularWeight: 288.30867

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=O)NCC(F)(F)F)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=O)NCC(F)(F)F)C

InChI

InChI=1S/C14H19F3N2O/c1-3-4-5-11-6-7-12(10(2)8-11)19-13(20)18-9-14(15,16)17/h6-8H,3-5,9H2,1-2H3,(H2,18,19,20)