5-tert-Butoxycarbonylamino-2-chloroisonicotinic acid

CAS Registry Number®

171178-46-4
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CAS Name

5-tert-Butoxycarbonylamino-2-chloroisonicotinic acid

Molecular Formula

C11H13ClN2O4

Molecular Mass

272.68

Cite this Page

5-tert-Butoxycarbonylamino-2-chloroisonicotinic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=171178-46-4 (retrieved 2024-07-01) (CAS RN: 171178-46-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H13ClN2O4/c1-11(2,3)18-10(17)14-7-5-13-8(12)4-6(7)9(15)16/h4-5H,1-3H3,(H,14,17)(H,15,16)

InChIKey

InChIKey=KOSPRFUMGCNGFJ-UHFFFAOYSA-N

SMILES

N(C(OC(C)(C)C)=O)C=1C(C(O)=O)=CC(Cl)=NC1

Canonical SMILES

O=C(O)C1=CC(Cl)=NC=C1NC(=O)OC(C)(C)C

Other Names for this Substance

  • 4-Pyridinecarboxylic acid, 2-chloro-5-[[(1,1-dimethylethoxy)carbonyl]amino]-
  • 2-Chloro-5-[[(1,1-dimethylethoxy)carbonyl]amino]-4-pyridinecarboxylic acid
  • 5-tert-Butoxycarbonylamino-2-chloroisonicotinic acid
  • 5-[(tert-Butoxy)carbonylamino]-2-chloropyridine-4-carboxylic acid