tert-butyl N-[(3S)-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamate

Systemtic Name: tert-butyl N-[(3S)-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamate Openeye Name: tert-butyl N-[(3S)-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamate CAS Name: N-[(3S)-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3S)-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamate Traditional Name: N-[(3S)-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamic acid tert-butyl ester Formula: C21H24F3NO3 MolecularWeight: 395.41537

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)NCC[C@@H](C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C21H24F3NO3/c1-20(2,3)28-19(26)25-14-13-18(15-7-5-4-6-8-15)27-17-11-9-16(10-12-17)21(22,23)24/h4-12,18H,13-14H2,1-3H3,(H,25,26)/t18-/m0/s1