tert-butyl 3-[3,5-bis(trifluoromethyl)phenoxy]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[3,5-bis(trifluoromethyl)phenoxy]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[3,5-bis(trifluoromethyl)phenoxy]pyrrolidine-1-carboxylate CAS Name: 3-[3,5-bis(trifluoromethyl)phenoxy]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3,5-bis(trifluoromethyl)phenoxy]pyrrolidine-1-carboxylate Traditional Name: 3-[3,5-bis(trifluoromethyl)phenoxy]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H19F6NO3 MolecularWeight: 399.328079

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)OC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)OC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H19F6NO3/c1-15(2,3)27-14(25)24-5-4-12(9-24)26-13-7-10(16(18,19)20)6-11(8-13)17(21,22)23/h6-8,12H,4-5,9H2,1-3H3