Butanoic acid, 4-amino-, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)

CAS Registry Number®

26727-22-0
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CAS Name

Butanoic acid, 4-amino-, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)

Molecular Formula

C11H15NO2.C7H8O3S

Cite this Page

Butanoic acid, 4-amino-, phenylmethyl ester, 4-methylbenzenesulfonate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=26727-22-0 (retrieved 2024-09-07) (CAS RN: 26727-22-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H15NO2.C7H8O3S/c12-8-4-7-11(13)14-9-10-5-2-1-3-6-10;1-6-2-4-7(5-3-6)11(8,9)10/h1-3,5-6H,4,7-9,12H2;2-5H,1H3,(H,8,9,10)

InChIKey

InChIKey=AVEADJJUOBFQIQ-UHFFFAOYSA-N

SMILES

C(OC(CCCN)=O)C1=CC=CC=C1.S(=O)(=O)(O)C1=CC=C(C)C=C1

Canonical SMILES

O=C(OCC=1C=CC=CC1)CCCN.O=S(=O)(O)C1=CC=C(C=C1)C

Other Names for this Substance

  • Butanoic acid, 4-amino-, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)
  • Butyric acid, 4-amino-, benzyl ester, p-toluenesulfonate
  • Butanoic acid, 4-amino-, phenylmethyl ester, 4-methylbenzenesulfonate
  • γ-Aminobutyric acid benzyl ester p-toluenesulfonate
  • Benzyl γ-aminobutyrate tosylate