| SpectraBase Spectrum ID |
J0wIPyBfGPy |
| Name |
(4R,5S)-5-(4-Chloro-phenyl)-4-cyano-1,5-dimethyl-3-phenyl-4,5-dihydro-1H-pyrazole-4-carboxylic acid methyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H18ClN3O2 |
| InChI |
InChI=1S/C20H18ClN3O2/c1-19(15-9-11-16(21)12-10-15)20(13-22,18(25)26-3)17(23-24(19)2)14-7-5-4-6-8-14/h4-12H,1-3H3/t19-,20+/m0/s1 |
| InChIKey |
BMXIHTCERPWCIE-VQTJNVASSA-N |
| Molecular Weight |
367.836 g/mol |
| SMILES |
[C@]1(C(=NN([C@]1(c1ccc(cc1)Cl)C)C)c1ccccc1)(C(=O)OC)C#N |
| SPLASH |
splash10-0a4i-0900000000-3174ac5b4ef04e4f88f7 |
| Source of Spectrum |
Y-31-230-4 |
| Synonyms |
(cis, syn)-3,5-Dimethyl-3-phenyl-4-cyano-4-(methoxycarbonyl)-5-(4'-chlorophenyl)pyrazoline
methyl (4R,5S)-5-(4-chlorophenyl)-4-cyano-1,5-dimethyl-3-phenyl-4,5-dihydro-1H-pyrazole-4-carboxylate |
| Wiley ID |
761417 |
