1-(2-bromanyl-4-methyl-phenyl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea

Systemtic Name: 1-(2-bromanyl-4-methyl-phenyl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea Openeye Name: 1-(2-bromo-4-methyl-phenyl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea CAS Name: 1-(2-bromo-4-methylphenyl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea IUPAC Name: 1-(2-bromo-4-methylphenyl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea Traditional Name: 1-(2-bromo-4-methyl-phenyl)-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea Formula: C16H12BrF3N2O3 MolecularWeight: 417.17729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC2(OC3=CC=CC=C3O2)C(F)(F)F)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC2(OC3=CC=CC=C3O2)C(F)(F)F)Br

InChI

InChI=1S/C16H12BrF3N2O3/c1-9-6-7-11(10(17)8-9)21-14(23)22-16(15(18,19)20)24-12-4-2-3-5-13(12)25-16/h2-8H,1H3,(H2,21,22,23)