(1S,2S)-2-{[7-fluoro-3-oxo-4-(prop-2-yn-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]carbamoyl}cyclohexanecarboxylic acid

Definition

(1S,2S)-2-{[7-fluoro-3-oxo-4-(prop-2-yn-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]carbamoyl}cyclohexanecarboxylic acid, term code RF-00007281-PAR of the EFSA Harmonized terminology for scientific research. IDENTIFIERS: IUPAC name: (1S,2S)-2-{[7-fluoro-3-oxo-4-(prop-2-yn-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]carbamoyl}cyclohexanecarboxylic acid. Chemical formula: C19H19FN2O5. Simplified molecular-input line-entry system (SMILES) notation: O=C(O)[C@H]3CCCC[C@@H]3C(=O)Nc1cc2c(cc1F)OCC(=O)N2CC#C. International Chemical Identifier (InChITM): InChI=1/C19H19FN2O5/c1-2-7-22-15-9-14(13(20)8-16(15)27-10-17(22)23)21-18(24)11-5-3-4-6-12(11)19(25)26/h1,8-9,11-12H,3-7,10H2,(H,21,24)(H,25,26)/t11-,12-/m0/s1.

Reference

  1. European Food Safety Authority 2023 Harmonized terminology for scientific research. (eng) Zenodo. doi: 10.5281/zenodo.7590216
Creator: Michael Rubinigg
Relationships
(1S,2S)-2-{[7-fluoro-3-oxo-4-(prop-2-yn-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]carbamoyl}cyclohexanecarboxylic acid
Properties

Label

(1S,2S)-2-{[7-fluoro-3-oxo-4-(prop-2-yn-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]carbamoyl}cyclohexanecarboxylic acid

EUPH Code (UID)

[5679]

EUPH IRI

https://app.pollinatorhub.eu/vocabulary/classes/5679

Dataset

EFSA DCF Catalogue

Descriptor

n/a

Created

2023-12-27

Updated

2025-02-11
Contributors

Class

Author: Michael Rubinigg

Definition

Author: Michael Rubinigg

Translation

Authors: Michael Rubinigg

Class translations

Filters

Columns

Language Expression Contributed By Status
English
(1S,2S)-2-{[7-fluoro-3-oxo-4-(prop-2-yn-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]carbamoyl}cyclohexanecarboxylic acid

Noun, Singular

Michael Rubinigg
Approved