1-(1,3-benzodioxol-5-ylmethyl)-3-[2-fluoranyl-3-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-fluoranyl-3-(trifluoromethyl)phenyl]urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-fluoro-3-(trifluoromethyl)phenyl]urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-fluoro-3-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-fluoro-3-(trifluoromethyl)phenyl]urea Traditional Name: 1-[2-fluoro-3-(trifluoromethyl)phenyl]-3-piperonyl-urea Formula: C16H12F4N2O3 MolecularWeight: 356.271693

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)NC3=CC=CC(=C3F)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)NC3=CC=CC(=C3F)C(F)(F)F

InChI

InChI=1S/C16H12F4N2O3/c17-14-10(16(18,19)20)2-1-3-11(14)22-15(23)21-7-9-4-5-12-13(6-9)25-8-24-12/h1-6H,7-8H2,(H2,21,22,23)