[2-[1-oxidanyl-1-[3-(trifluoromethyl)phenyl]propyl]phenyl] N-butylcarbamate

Systemtic Name: [2-[1-oxidanyl-1-[3-(trifluoromethyl)phenyl]propyl]phenyl] N-butylcarbamate Openeye Name: [2-[1-hydroxy-1-[3-(trifluoromethyl)phenyl]propyl]phenyl] N-butylcarbamate CAS Name: N-butylcarbamic acid [2-[1-hydroxy-1-[3-(trifluoromethyl)phenyl]propyl]phenyl] ester IUPAC Name: [2-[1-hydroxy-1-[3-(trifluoromethyl)phenyl]propyl]phenyl] N-butylcarbamate Traditional Name: N-butylcarbamic acid [2-[1-hydroxy-1-[3-(trifluoromethyl)phenyl]propyl]phenyl] ester Formula: C21H24F3NO3 MolecularWeight: 395.41537

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)OC1=CC=CC=C1C(CC)(C2=CC(=CC=C2)C(F)(F)F)O

Isomeric SMILES

CCCCNC(=O)OC1=CC=CC=C1C(CC)(C2=CC(=CC=C2)C(F)(F)F)O

InChI

InChI=1S/C21H24F3NO3/c1-3-5-13-25-19(26)28-18-12-7-6-11-17(18)20(27,4-2)15-9-8-10-16(14-15)21(22,23)24/h6-12,14,27H,3-5,13H2,1-2H3,(H,25,26)