(αS)-4-Chloro-α-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]benzenepropanoic acid

CAS Registry Number®

853681-17-1
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CAS Name

(αS)-4-Chloro-α-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]benzenepropanoic acid

Molecular Formula

C15H20ClNO4

Molecular Mass

313.78

Cite this Page

(αS)-4-Chloro-α-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]benzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=853681-17-1 (retrieved 2024-08-27) (CAS RN: 853681-17-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H20ClNO4/c1-15(2,3)21-14(20)17-9-11(13(18)19)8-10-4-6-12(16)7-5-10/h4-7,11H,8-9H2,1-3H3,(H,17,20)(H,18,19)/t11-/m0/s1

InChIKey

InChIKey=DJJSHFXWIZOOFF-NSHDSACASA-N

SMILES

C([C@@H](CNC(OC(C)(C)C)=O)C(O)=O)C1=CC=C(Cl)C=C1

Canonical SMILES

O=C(OC(C)(C)C)NCC(C(=O)O)CC1=CC=C(Cl)C=C1

Other Names for this Substance

  • Benzenepropanoic acid, 4-chloro-α-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-, (αS)-
  • (αS)-4-Chloro-α-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]benzenepropanoic acid