tert-butyl N-[1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpyrrolidin-3-yl]carbamate

Systemtic Name: tert-butyl N-[1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpyrrolidin-3-yl]carbamate Openeye Name: tert-butyl N-[1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpyrrolidin-3-yl]carbamate CAS Name: N-[1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-3-pyrrolidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpyrrolidin-3-yl]carbamate Traditional Name: N-[1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpyrrolidin-3-yl]carbamic acid tert-butyl ester Formula: C17H20F6N2O4S MolecularWeight: 462.407119

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H20F6N2O4S/c1-15(2,3)29-14(26)24-12-4-5-25(9-12)30(27,28)13-7-10(16(18,19)20)6-11(8-13)17(21,22)23/h6-8,12H,4-5,9H2,1-3H3,(H,24,26)