SpectraBase Spectrum ID |
L5ig9vzRXsG |
Name |
3H-Pyrazole-4-carboxylic acid, 5-[1-(4-chlorophenyl)-1-phenylethyl]-4-cyano-4,5-dihydro-3-methyl-3-phenyl-, methyl ester |
CAS Registry Number |
117918-90-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H24ClN3O2 |
InChI |
InChI=1S/C27H24ClN3O2/c1-25(19-10-6-4-7-11-19,20-14-16-22(28)17-15-20)23-27(18-29,24(32)33-3)26(2,31-30-23)21-12-8-5-9-13-21/h4-17,23H,1-3H3 |
InChIKey |
QBHWHMJYDFTSIP-UHFFFAOYSA-N |
Molecular Weight |
457.961 g/mol |
SMILES |
C1(C(N=NC1(c1ccccc1)C)C(c1ccc(cc1)Cl)(c1ccccc1)C)(C(=O)OC)C#N |
SPLASH |
splash10-004i-0090000000-678a6b27b3e27671a649 |
Source of Spectrum |
J-54-638-0 |
Synonyms |
Methyl 5-[1-(4-chlorophenyl)-1-phenylethyl]-4-cyano-3-methyl-3-phenyl-4,5-dihydro-3H-pyrazole-4-carboxylate |
Wiley ID |
1389652 |