L-Leucine, 4-fluoro-N-[(1S)-2,2,2-trifluoro-1-[4′-(methylsulfonyl)[1,1′-biphenyl]-4-yl]ethyl]-, compd. with N-cyclohexylcyclohexanamine (1:1)

CAS Registry Number®

1064076-86-3

CAS Name

L-Leucine, 4-fluoro-N-[(1S)-2,2,2-trifluoro-1-[4′-(methylsulfonyl)[1,1′-biphenyl]-4-yl]ethyl]-, compd. with N-cyclohexylcyclohexanamine (1:1)

Molecular Formula

C21H23F4NO4S.C12H23N

Cite this Page

L-Leucine, 4-fluoro-N-[(1S)-2,2,2-trifluoro-1-[4′-(methylsulfonyl)[1,1′-biphenyl]-4-yl]ethyl]-, compd. with N-cyclohexylcyclohexanamine (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1064076-86-3 (retrieved 2024-11-30) (CAS RN: 1064076-86-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H23F4NO4S.C12H23N/c1-20(2,22)12-17(19(27)28)26-18(21(23,24)25)15-6-4-13(5-7-15)14-8-10-16(11-9-14)31(3,29)30;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h4-11,17-18,26H,12H2,1-3H3,(H,27,28);11-13H,1-10H2/t17-,18-;/m0./s1

InChIKey

InChIKey=XPOZLVHDSYOJLL-APTPAJQOSA-N

SMILES

[C@@H](N[C@@H](CC(C)(C)F)C(O)=O)([C@@](F)(F)F)C1=CC=C(C=C1)C2=CC=C(S(C)(=O)=O)C=C2.N(C1CCCCC1)C2CCCCC2

Canonical SMILES

O=C(O)C(NC(C1=CC=C(C=C1)C=2C=CC(=CC2)S(=O)(=O)C)C(F)(F)F)CC(F)(C)C.N(C1CCCCC1)C2CCCCC2

Other Names for this Substance

  • L-Leucine, 4-fluoro-N-[(1S)-2,2,2-trifluoro-1-[4′-(methylsulfonyl)[1,1′-biphenyl]-4-yl]ethyl]-, compd. with N-cyclohexylcyclohexanamine (1:1)

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