1,1-Dimethylethyl N-(3-chloro-6-fluoro-5-isoquinolinyl)carbamate

CAS Registry Number®

1841079-96-6
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CAS Name

1,1-Dimethylethyl N-(3-chloro-6-fluoro-5-isoquinolinyl)carbamate

Molecular Formula

C14H14ClFN2O2

Molecular Mass

296.72

Cite this Page

1,1-Dimethylethyl N-(3-chloro-6-fluoro-5-isoquinolinyl)carbamate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1841079-96-6 (retrieved 2024-09-06) (CAS RN: 1841079-96-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H14ClFN2O2/c1-14(2,3)20-13(19)18-12-9-6-11(15)17-7-8(9)4-5-10(12)16/h4-7H,1-3H3,(H,18,19)

InChIKey

InChIKey=NPAPQIKTDPNOSG-UHFFFAOYSA-N

SMILES

N(C(OC(C)(C)C)=O)C=1C2=C(C=CC1F)C=NC(Cl)=C2

Canonical SMILES

O=C(OC(C)(C)C)NC1=C(F)C=CC2=CN=C(Cl)C=C21

Other Names for this Substance

  • Carbamic acid, N-(3-chloro-6-fluoro-5-isoquinolinyl)-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl N-(3-chloro-6-fluoro-5-isoquinolinyl)carbamate