L-Leucine, N-acetyl-, compd. with (αS)-3-ethoxy-4-methoxy-α-[(methylsulfonyl)methyl]benzenemethanamine (1:1)

CAS Registry Number®

608141-43-1

CAS Name

L-Leucine, N-acetyl-, compd. with (αS)-3-ethoxy-4-methoxy-α-[(methylsulfonyl)methyl]benzenemethanamine (1:1)

Molecular Formula

C12H19NO4S.C8H15NO3

Cite this Page

L-Leucine, N-acetyl-, compd. with (αS)-3-ethoxy-4-methoxy-α-[(methylsulfonyl)methyl]benzenemethanamine (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=608141-43-1 (retrieved 2024-11-24) (CAS RN: 608141-43-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H19NO4S.C8H15NO3/c1-4-17-12-7-9(5-6-11(12)16-2)10(13)8-18(3,14)15;1-5(2)4-7(8(11)12)9-6(3)10/h5-7,10H,4,8,13H2,1-3H3;5,7H,4H2,1-3H3,(H,9,10)(H,11,12)/t10-;7-/m10/s1

InChIKey

InChIKey=KJZXYHPZWRDLAR-JIJBYVMQSA-N

SMILES

[C@H](CS(C)(=O)=O)(N)C1=CC(OCC)=C(OC)C=C1.[C@@H](CC(C)C)(NC(C)=O)C(O)=O

Canonical SMILES

O=C(O)C(NC(=O)C)CC(C)C.O=S(=O)(C)CC(N)C1=CC=C(OC)C(OCC)=C1

Other Names for this Substance

  • L-Leucine, N-acetyl-, compd. with (αS)-3-ethoxy-4-methoxy-α-[(methylsulfonyl)methyl]benzenemethanamine (1:1)
  • (S)-1-(3-Ethoxy-4-methoxyphenyl)-2-(methylsulfonyl)ethylamine N-acetyl-L-leucine salt

Deleted or Replaced CAS Registry Numbers

1710277-48-7, 2099064-21-6

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