(βS)-β-[[(Phenylmethoxy)carbonyl]amino]benzenebutanoic acid

CAS Registry Number®

26250-86-2
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CAS Name

(βS)-β-[[(Phenylmethoxy)carbonyl]amino]benzenebutanoic acid

Molecular Formula

C18H19NO4

Molecular Mass

313.35

Cite this Page

(βS)-β-[[(Phenylmethoxy)carbonyl]amino]benzenebutanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=26250-86-2 (retrieved 2024-08-18) (CAS RN: 26250-86-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    116-118 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H19NO4/c20-17(21)12-16(11-14-7-3-1-4-8-14)19-18(22)23-13-15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,19,22)(H,20,21)/t16-/m0/s1

InChIKey

InChIKey=WUIQVOMIYLNNEC-INIZCTEOSA-N

SMILES

[C@@H](CC1=CC=CC=C1)(NC(OCC2=CC=CC=C2)=O)CC(O)=O

Canonical SMILES

O=C(O)CC(NC(=O)OCC=1C=CC=CC1)CC=2C=CC=CC2

Other Names for this Substance

  • Benzenebutanoic acid, β-[[(phenylmethoxy)carbonyl]amino]-, (βS)-
  • Butyric acid, 3-(carboxyamino)-4-phenyl-, N-benzyl ester, L-
  • Benzenebutanoic acid, β-[[(phenylmethoxy)carbonyl]amino]-, (S)-
  • (βS)-β-[[(Phenylmethoxy)carbonyl]amino]benzenebutanoic acid
  • (3S)-3-[[(Benzyloxy)carbonyl]amino]-4-phenylbutanoic acid