tert-butyl carbamate; 1-(phenethyloxymethyl)-3,5-bis(trifluoromethyl)benzene

Systemtic Name: tert-butyl carbamate; 1-(phenethyloxymethyl)-3,5-bis(trifluoromethyl)benzene Openeye Name: tert-butyl carbamate; 1-(phenethyloxymethyl)-3,5-bis(trifluoromethyl)benzene CAS Name: carbamic acid tert-butyl ester; 1-(phenethyloxymethyl)-3,5-bis(trifluoromethyl)benzene IUPAC Name: tert-butyl carbamate; 1-(phenethyloxymethyl)-3,5-bis(trifluoromethyl)benzene Traditional Name: carbamic acid tert-butyl ester; 1-(phenethyloxymethyl)-3,5-bis(trifluoromethyl)benzene Formula: C22H25F6NO3 MolecularWeight: 465.429219

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N.C1=CC=C(C=C1)CCOCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N.C1=CC=C(C=C1)CCOCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H14F6O.C5H11NO2/c18-16(19,20)14-8-13(9-15(10-14)17(21,22)23)11-24-7-6-12-4-2-1-3-5-12;1-5(2,3)8-4(6)7/h1-5,8-10H,6-7,11H2;1-3H3,(H2,6,7)