1-cyclododecyl-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea

Systemtic Name: 1-cyclododecyl-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea Openeye Name: 1-cyclododecyl-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea CAS Name: 1-cyclododecyl-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea IUPAC Name: 1-cyclododecyl-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea Traditional Name: 1-cyclododecyl-3-[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]urea Formula: C21H29F3N2O3 MolecularWeight: 414.46177

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)NC(=O)NC2(OC3=CC=CC=C3O2)C(F)(F)F

Isomeric SMILES

C1CCCCCC(CCCCC1)NC(=O)NC2(OC3=CC=CC=C3O2)C(F)(F)F

InChI

InChI=1S/C21H29F3N2O3/c22-20(23,24)21(28-17-14-10-11-15-18(17)29-21)26-19(27)25-16-12-8-6-4-2-1-3-5-7-9-13-16/h10-11,14-16H,1-9,12-13H2,(H2,25,26,27)