tert-butyl N-[2-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-1-phenyl-hex-5-enyl]carbamate

Systemtic Name: tert-butyl N-[2-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-1-phenyl-hex-5-enyl]carbamate Openeye Name: tert-butyl N-[2-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-1-phenyl-hex-5-enyl]carbamate CAS Name: N-[2-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-1-phenylhex-5-enyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-1-phenylhex-5-enyl]carbamate Traditional Name: N-[2-[3,5-bis(trifluoromethyl)benzyl]oxy-1-phenyl-hex-5-enyl]carbamic acid tert-butyl ester Formula: C26H29F6NO3 MolecularWeight: 517.503779

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=CC=CC=C1)C(CCC=C)OCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)NC(C1=CC=CC=C1)C(CCC=C)OCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C26H29F6NO3/c1-5-6-12-21(22(18-10-8-7-9-11-18)33-23(34)36-24(2,3)4)35-16-17-13-19(25(27,28)29)15-20(14-17)26(30,31)32/h5,7-11,13-15,21-22H,1,6,12,16H2,2-4H3,(H,33,34)